 | | MYW | | Name: | Nidocarborane | | Formula: | C5 H8 B9 N O2 S | | SMILES: | N[S](=O)(=O)CCC[C+]123[B]45[B+]67[B-]89[C]1%10[B]8%11%12[B]69%13[B]47%14[B]25%15[B]3%10%11[B]%12%13%14%15 | | InChi: | InChI=1S/C5H8B9NO2S/c15-18(16,17)3-1-2-5-4-6-8-7(5)11(5)9(4,5)10(4,6)12(6,8)13(7,8,11)14(9,10,11)12/h1-3H2,(H2,15,16,17)/q+1 | | Definition date: | 2019-10-29 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 |
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 | | K48 | | Name: | 5-azanyl-4-phenyl-thiophene-2-carboximidamide | | Formula: | C11 H11 N3 S | | SMILES: | NC(=N)c1sc(N)c(c1)c2ccccc2 | | InChi: | InChI=1S/C11H11N3S/c12-10(13)9-6-8(11(14)15-9)7-4-2-1-3-5-7/h1-6H,14H2,(H3,12,13) | | Definition date: | 2019-04-19 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 5-azanyl-4-phenyl-thiophene-2-carboximidamide |
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 | | K5Z | | Name: | 5-(3-azanylpropyl)-4-phenyl-thiophene-2-carboximidamide | | Formula: | C14 H17 N3 S | | SMILES: | NCCCc1sc(cc1c2ccccc2)C(N)=N | | InChi: | InChI=1S/C14H17N3S/c15-8-4-7-12-11(9-13(18-12)14(16)17)10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8,15H2,(H3,16,17) | | Definition date: | 2019-04-29 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 5-(3-azanylpropyl)-4-phenyl-thiophene-2-carboximidamide |
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 | | K65 | | Name: | ~{N}-[2-(5-carbamimidoylthiophen-3-yl)phenyl]prop-2-enamide | | Formula: | C14 H13 N3 O S | | SMILES: | NC(=N)c1scc(c1)c2ccccc2NC(=O)C=C | | InChi: | InChI=1S/C14H13N3OS/c1-2-13(18)17-11-6-4-3-5-10(11)9-7-12(14(15)16)19-8-9/h2-8H,1H2,(H3,15,16)(H,17,18) | | Definition date: | 2019-04-29 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | ~{N}-[2-(5-carbamimidoylthiophen-3-yl)phenyl]prop-2-enamide |
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 | | K6B | | Name: | 7-(6-azanylpyridin-2-yl)-1-benzothiophene-2-carboximidamide | | Formula: | C14 H12 N4 S | | SMILES: | NC(=N)c1sc2c(cccc2c3cccc(N)n3)c1 | | InChi: | InChI=1S/C14H12N4S/c15-12-6-2-5-10(18-12)9-4-1-3-8-7-11(14(16)17)19-13(8)9/h1-7H,(H2,15,18)(H3,16,17) | | Definition date: | 2019-04-30 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 7-(6-azanylpyridin-2-yl)-1-benzothiophene-2-carboximidamide |
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 | | K6N | | Name: | 7-(3-azanyl-4-methyl-pyrazol-1-yl)-1-benzothiophene-2-carboximidamide | | Formula: | C13 H13 N5 S | | SMILES: | Cc1cn(nc1N)c2cccc3cc(sc23)C(N)=N | | InChi: | InChI=1S/C13H13N5S/c1-7-6-18(17-13(7)16)9-4-2-3-8-5-10(12(14)15)19-11(8)9/h2-6H,1H3,(H3,14,15)(H2,16,17) | | Definition date: | 2019-04-30 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 7-(3-azanyl-4-methyl-pyrazol-1-yl)-1-benzothiophene-2-carboximidamide |
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 | | K6T | | Name: | 5-[(3-aminophenyl)amino]-4-phenyl-thiophene-2-carboximidamide | | Formula: | C17 H16 N4 S | | SMILES: | NC(=N)c1sc(Nc2cccc(N)c2)c(c1)c3ccccc3 | | InChi: | InChI=1S/C17H16N4S/c18-12-7-4-8-13(9-12)21-17-14(10-15(22-17)16(19)20)11-5-2-1-3-6-11/h1-10,21H,18H2,(H3,19,20) | | Definition date: | 2019-04-30 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 5-[(3-aminophenyl)amino]-4-phenyl-thiophene-2-carboximidamide |
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 | | K6W | | Name: | 4-phenyl-5-(phenylmethyl)thiophene-2-carboximidamide | | Formula: | C18 H16 N2 S | | SMILES: | NC(=N)c1sc(Cc2ccccc2)c(c1)c3ccccc3 | | InChi: | InChI=1S/C18H16N2S/c19-18(20)17-12-15(14-9-5-2-6-10-14)16(21-17)11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H3,19,20) | | Definition date: | 2019-04-30 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 4-phenyl-5-(phenylmethyl)thiophene-2-carboximidamide |
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 | | K6Z | | Name: | 4-phenyl-5-phenylazanyl-thiophene-2-carboximidamide | | Formula: | C17 H15 N3 S | | SMILES: | NC(=N)c1sc(Nc2ccccc2)c(c1)c3ccccc3 | | InChi: | InChI=1S/C17H15N3S/c18-16(19)15-11-14(12-7-3-1-4-8-12)17(21-15)20-13-9-5-2-6-10-13/h1-11,20H,(H3,18,19) | | Definition date: | 2019-04-30 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 4-phenyl-5-phenylazanyl-thiophene-2-carboximidamide |
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 | | X33 | | Name: | Carborane inhibitor | | Formula: | C5 H8 B10 N O2 S | | SMILES: | N[S](=O)(=O)CCC[C++]1234[B]567[B]89%10[B]%11%12%13[B]58%14[B]%11%15%16[B]%12%17%18[B]9%13%19[B]16%10[B]2%17%19[C+]3%15%18[B]47%14%16 | | InChi: | InChI=1S/C5H8B10NO2S/c16-19(17,18)3-1-2-5-4-6(5)8(4)9(4)7(4,5)11(5)10(5,6)12(6,8)14(8,9)13(7,9,11)15(10,11,12)14/h1-3H2,(H2,16,17,18)/q+3 | | Definition date: | 2019-10-23 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 |
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 | | L1T | | Name: | 4-methyl-5-phenyl-thiophene-2-carboximidamide | | Formula: | C12 H12 N2 S | | SMILES: | Cc1cc(sc1c2ccccc2)C(N)=N | | InChi: | InChI=1S/C12H12N2S/c1-8-7-10(12(13)14)15-11(8)9-5-3-2-4-6-9/h2-7H,1H3,(H3,13,14) | | Definition date: | 2019-07-15 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 4-methyl-5-phenyl-thiophene-2-carboximidamide |
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 | | JT2 | | Name: | 4-[[(2~{S})-1-azanylpropan-2-yl]amino]-6-(sulfanylmethyl)-1-benzothiophene-2-carboximidamide | | Formula: | C13 H18 N4 S2 | | SMILES: | C[CH](CN)Nc1cc(CS)cc2sc(cc12)C(N)=N | | InChi: | InChI=1S/C13H18N4S2/c1-7(5-14)17-10-2-8(6-18)3-11-9(10)4-12(19-11)13(15)16/h2-4,7,17-18H,5-6,14H2,1H3,(H3,15,16)/t7-/m0/s1 | | Definition date: | 2019-03-26 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 4-[[(2~{S})-1-azanylpropan-2-yl]amino]-6-(sulfanylmethyl)-1-benzothiophene-2-carboximidamide |
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 | | K7N | | Name: | 5-[1-(2-azanylethyl)imidazol-4-yl]-4-phenyl-thiophene-2-carboximidamide | | Formula: | C16 H17 N5 S | | SMILES: | NCCn1cnc(c1)c2sc(cc2c3ccccc3)C(N)=N | | InChi: | InChI=1S/C16H17N5S/c17-6-7-21-9-13(20-10-21)15-12(8-14(22-15)16(18)19)11-4-2-1-3-5-11/h1-5,8-10H,6-7,17H2,(H3,18,19) | | Definition date: | 2019-05-01 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 5-[1-(2-azanylethyl)imidazol-4-yl]-4-phenyl-thiophene-2-carboximidamide |
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 | | K7Q | | Name: | ~{N}-(2-azanylethyl)-2-carbamimidoyl-7-methoxy-1-benzothiophene-4-carboxamide | | Formula: | C13 H16 N4 O2 S | | SMILES: | COc1ccc(C(=O)NCCN)c2cc(sc12)C(N)=N | | InChi: | InChI=1S/C13H16N4O2S/c1-19-9-3-2-7(13(18)17-5-4-14)8-6-10(12(15)16)20-11(8)9/h2-3,6H,4-5,14H2,1H3,(H3,15,16)(H,17,18) | | Definition date: | 2019-05-01 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | ~{N}-(2-azanylethyl)-2-carbamimidoyl-7-methoxy-1-benzothiophene-4-carboxamide |
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 | | UU1 | | Name: | 2-(4-bromo-1H-pyrazol-1-yl)ethan-1-ol | | Formula: | C5 H7 Br N2 O | | SMILES: | n1cc(cn1CCO)Br | | InChi: | InChI=1S/C5H7BrN2O/c6-5-3-7-8(4-5)1-2-9/h3-4,9H,1-2H2 | | Definition date: | 2020-06-02 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 2-(4-bromo-1H-pyrazol-1-yl)ethan-1-ol |
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 | | UUG | | Name: | (4-bromo-2-methoxyphenyl)methanol | | Formula: | C8 H9 Br O2 | | SMILES: | c1(c(OC)cc(cc1)Br)CO | | InChi: | InChI=1S/C8H9BrO2/c1-11-8-4-7(9)3-2-6(8)5-10/h2-4,10H,5H2,1H3 | | Definition date: | 2020-06-02 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | (4-bromo-2-methoxyphenyl)methanol |
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 | | K8W | | Name: | 7-(6-azanyl-5-methyl-pyridin-2-yl)-1-benzothiophene-2-carboximidamide | | Formula: | C15 H14 N4 S | | SMILES: | Cc1ccc(nc1N)c2cccc3cc(sc23)C(N)=N | | InChi: | InChI=1S/C15H14N4S/c1-8-5-6-11(19-15(8)18)10-4-2-3-9-7-12(14(16)17)20-13(9)10/h2-7H,1H3,(H3,16,17)(H2,18,19) | | Definition date: | 2019-05-06 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 7-(6-azanyl-5-methyl-pyridin-2-yl)-1-benzothiophene-2-carboximidamide |
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 | | UUJ | | Name: | 5-bromo-2-hydroxybenzonitrile | | Formula: | C7 H4 Br N O | | SMILES: | c1(cc(c(cc1)O)C#N)Br | | InChi: | InChI=1S/C7H4BrNO/c8-6-1-2-7(10)5(3-6)4-9/h1-3,10H | | Definition date: | 2020-06-02 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 5-bromo-2-hydroxybenzonitrile |
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 | | K92 | | Name: | 5-[3-(2-azanylethyl)imidazol-4-yl]-4-phenyl-thiophene-2-carboximidamide | | Formula: | C16 H17 N5 S | | SMILES: | NCCn1cncc1c2sc(cc2c3ccccc3)C(N)=N | | InChi: | InChI=1S/C16H17N5S/c17-6-7-21-10-20-9-13(21)15-12(8-14(22-15)16(18)19)11-4-2-1-3-5-11/h1-5,8-10H,6-7,17H2,(H3,18,19) | | Definition date: | 2019-05-06 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 5-[3-(2-azanylethyl)imidazol-4-yl]-4-phenyl-thiophene-2-carboximidamide |
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 | | UUM | | Name: | 5-methyl-N-(1-methyl-1H-pyrazol-4-yl)-1,2-oxazole-3-carboxamide | | Formula: | C9 H10 N4 O2 | | SMILES: | N(c1cn(C)nc1)C(=O)c2noc(C)c2 | | InChi: | InChI=1S/C9H10N4O2/c1-6-3-8(12-15-6)9(14)11-7-4-10-13(2)5-7/h3-5H,1-2H3,(H,11,14) | | Definition date: | 2020-06-02 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 5-methyl-N-(1-methyl-1H-pyrazol-4-yl)-1,2-oxazole-3-carboxamide |
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 | | UUP | | Name: | N-cyclopropylpyrazolo[1,5-a]pyrimidine-3-carboxamide | | Formula: | C10 H10 N4 O | | SMILES: | n1n3cccnc3c(c1)C(NC2CC2)=O | | InChi: | InChI=1S/C10H10N4O/c15-10(13-7-2-3-7)8-6-12-14-5-1-4-11-9(8)14/h1,4-7H,2-3H2,(H,13,15) | | Definition date: | 2020-06-02 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | N-cyclopropylpyrazolo[1,5-a]pyrimidine-3-carboxamide |
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 | | UUS | | Name: | 4-bromo-1-(2-hydroxyethyl)pyridin-2(1H)-one | | Formula: | C7 H8 Br N O2 | | SMILES: | C=1C(Br)=CC(N(C=1)CCO)=O | | InChi: | InChI=1S/C7H8BrNO2/c8-6-1-2-9(3-4-10)7(11)5-6/h1-2,5,10H,3-4H2 | | Definition date: | 2020-06-02 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 4-bromo-1-(2-hydroxyethyl)pyridin-2(1H)-one |
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 | | UUV | | Name: | 4-bromo-1-(2-methoxyethyl)-1H-pyrazole | | Formula: | C6 H9 Br N2 O | | SMILES: | n1n(cc(c1)Br)CCOC | | InChi: | InChI=1S/C6H9BrN2O/c1-10-3-2-9-5-6(7)4-8-9/h4-5H,2-3H2,1H3 | | Definition date: | 2020-06-02 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 4-bromo-1-(2-methoxyethyl)-1H-pyrazole |
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 | | UUY | | Name: | 2-[methyl(pyridin-2-yl)amino]ethan-1-ol | | Formula: | C8 H12 N2 O | | SMILES: | n1ccccc1N(C)CCO | | InChi: | InChI=1S/C8H12N2O/c1-10(6-7-11)8-4-2-3-5-9-8/h2-5,11H,6-7H2,1H3 | | Definition date: | 2020-06-02 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 2-[methyl(pyridin-2-yl)amino]ethan-1-ol |
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 | | UV1 | | Name: | 6-methoxy-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one | | Formula: | C11 H13 N O2 | | SMILES: | c2c1NC(CCCc1c(OC)cc2)=O | | InChi: | InChI=1S/C11H13NO2/c1-14-10-6-3-5-9-8(10)4-2-7-11(13)12-9/h3,5-6H,2,4,7H2,1H3,(H,12,13) | | Definition date: | 2020-06-02 | | Last modified: | 2020-06-12 | | Release date: | 2020-06-17 | | Identifier: | 6-methoxy-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one |
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