 | | VI5 | | Name: | N-(3-fluorophenyl)-N~2~-methylglycinamide | | Formula: | C9 H11 F N2 O | | SMILES: | O=C(Nc1cccc(F)c1)CNC | | InChi: | InChI=1S/C9H11FN2O/c1-11-6-9(13)12-8-4-2-3-7(10)5-8/h2-5,11H,6H2,1H3,(H,12,13) | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-(3-fluorophenyl)-N~2~-methylglycinamide |
|
 | | VI8 | | Name: | 3-{[(pyridin-3-yl)methyl]amino}benzoic acid | | Formula: | C13 H12 N2 O2 | | SMILES: | O=C(O)c1cc(NCc2cccnc2)ccc1 | | InChi: | InChI=1S/C13H12N2O2/c16-13(17)11-4-1-5-12(7-11)15-9-10-3-2-6-14-8-10/h1-8,15H,9H2,(H,16,17) | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 3-{[(pyridin-3-yl)methyl]amino}benzoic acid |
|
 | | VIE | | Name: | 2-(aminomethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-2-amine | | Formula: | C12 H18 N2 | | SMILES: | CN(C)C1(Cc2ccccc2C1)CN | | InChi: | InChI=1S/C12H18N2/c1-14(2)12(9-13)7-10-5-3-4-6-11(10)8-12/h3-6H,7-9,13H2,1-2H3 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 2-(aminomethyl)-N,N-dimethyl-2,3-dihydro-1H-inden-2-amine |
|
 | | VIK | | Name: | methyl [(3S)-1,1-dioxo-1lambda~6~-thiolan-3-yl]acetate | | Formula: | C7 H12 O4 S | | SMILES: | O=S1(=O)CCC(CC(=O)OC)C1 | | InChi: | InChI=1S/C7H12O4S/c1-11-7(8)4-6-2-3-12(9,10)5-6/h6H,2-5H2,1H3/t6-/m1/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | methyl [(3S)-1,1-dioxo-1lambda~6~-thiolan-3-yl]acetate |
|
 | | VIP | | Name: | 3-[(2S)-2-amino-1-hydroxypropan-2-yl]phenol | | Formula: | C9 H13 N O2 | | SMILES: | NC(C)(CO)c1cc(O)ccc1 | | InChi: | InChI=1S/C9H13NO2/c1-9(10,6-11)7-3-2-4-8(12)5-7/h2-5,11-12H,6,10H2,1H3/t9-/m1/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 3-[(2S)-2-amino-1-hydroxypropan-2-yl]phenol |
|
 | | VIX | | Name: | (2R)-(4-chlorophenyl)(morpholin-4-yl)acetic acid | | Formula: | C12 H14 Cl N O3 | | SMILES: | OC(=O)C(N1CCOCC1)c1ccc(Cl)cc1 | | InChi: | InChI=1S/C12H14ClNO3/c13-10-3-1-9(2-4-10)11(12(15)16)14-5-7-17-8-6-14/h1-4,11H,5-8H2,(H,15,16)/t11-/m1/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2R)-(4-chlorophenyl)(morpholin-4-yl)acetic acid |
|
 | | VJ0 | | Name: | (1S)-1-(3-fluoro-4-methoxyphenyl)ethan-1-amine | | Formula: | C9 H12 F N O | | SMILES: | Fc1cc(ccc1OC)C(C)N | | InChi: | InChI=1S/C9H12FNO/c1-6(11)7-3-4-9(12-2)8(10)5-7/h3-6H,11H2,1-2H3/t6-/m0/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (1S)-1-(3-fluoro-4-methoxyphenyl)ethan-1-amine |
|
 | | VJ9 | | Name: | ethyl 4-fluoro-3-nitrobenzoate | | Formula: | C9 H8 F N O4 | | SMILES: | Fc1ccc(cc1N(=O)=O)C(=O)OCC | | InChi: | InChI=1S/C9H8FNO4/c1-2-15-9(12)6-3-4-7(10)8(5-6)11(13)14/h3-5H,2H2,1H3 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | ethyl 4-fluoro-3-nitrobenzoate |
|
 | | VJI | | Name: | (1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethane-1,2-diamine | | Formula: | C10 H14 N2 O2 | | SMILES: | NCC(N)c1ccc2OCCOc2c1 | | InChi: | InChI=1S/C10H14N2O2/c11-6-8(12)7-1-2-9-10(5-7)14-4-3-13-9/h1-2,5,8H,3-4,6,11-12H2/t8-/m0/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethane-1,2-diamine |
|
 | | VJO | | Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)methanesulfonamide | | Formula: | C9 H11 N O4 S | | SMILES: | CS(=O)(=O)Nc1ccc2OCCOc2c1 | | InChi: | InChI=1S/C9H11NO4S/c1-15(11,12)10-7-2-3-8-9(6-7)14-5-4-13-8/h2-3,6,10H,4-5H2,1H3 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)methanesulfonamide |
|
 | | VJY | | Name: | N-[(5-acetylthiophen-2-yl)methyl]acetamide | | Formula: | C9 H11 N O2 S | | SMILES: | O=C(C)NCc1ccc(s1)C(C)=O | | InChi: | InChI=1S/C9H11NO2S/c1-6(11)9-4-3-8(13-9)5-10-7(2)12/h3-4H,5H2,1-2H3,(H,10,12) | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-[(5-acetylthiophen-2-yl)methyl]acetamide |
|
 | | VKF | | Name: | 4-(difluoromethyl)benzoic acid | | Formula: | C8 H6 F2 O2 | | SMILES: | FC(F)c1ccc(cc1)C(=O)O | | InChi: | InChI=1S/C8H6F2O2/c9-7(10)5-1-3-6(4-2-5)8(11)12/h1-4,7H,(H,11,12) | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 4-(difluoromethyl)benzoic acid |
|
 | | VKO | | Name: | 1-{[(2-methylphenyl)methyl]carbamoyl}cyclopropane-1-carboxylic acid | | Formula: | C13 H15 N O3 | | SMILES: | O=C(O)C1(CC1)C(=O)NCc1ccccc1C | | InChi: | InChI=1S/C13H15NO3/c1-9-4-2-3-5-10(9)8-14-11(15)13(6-7-13)12(16)17/h2-5H,6-8H2,1H3,(H,14,15)(H,16,17) | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 1-{[(2-methylphenyl)methyl]carbamoyl}cyclopropane-1-carboxylic acid |
|
 | | VKX | | Name: | (5R,8aS)-8a-phenylhexahydropyrrolo[1,2-a]pyrimidin-6(2H)-one | | Formula: | C13 H16 N2 O | | SMILES: | O=C1CCC2(NCCCN12)c1ccccc1 | | InChi: | InChI=1S/C13H16N2O/c16-12-7-8-13(11-5-2-1-3-6-11)14-9-4-10-15(12)13/h1-3,5-6,14H,4,7-10H2/t13-/m0/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (5R,8aS)-8a-phenylhexahydropyrrolo[1,2-a]pyrimidin-6(2H)-one |
|
 | | VL8 | | Name: | (2R)-2-(3,4-dichlorophenoxy)-N-methylbutanamide | | Formula: | C11 H13 Cl2 N O2 | | SMILES: | Clc1ccc(OC(CC)C(=O)NC)cc1Cl | | InChi: | InChI=1S/C11H13Cl2NO2/c1-3-10(11(15)14-2)16-7-4-5-8(12)9(13)6-7/h4-6,10H,3H2,1-2H3,(H,14,15)/t10-/m1/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2R)-2-(3,4-dichlorophenoxy)-N-methylbutanamide |
|
 | | VLI | | Name: | (3S)-3-hydroxy-6-methyl-3-(trifluoromethyl)-1,3-dihydro-2H-indol-2-one | | Formula: | C10 H8 F3 N O2 | | SMILES: | FC(F)(F)C1(O)c2ccc(C)cc2NC1=O | | InChi: | InChI=1S/C10H8F3NO2/c1-5-2-3-6-7(4-5)14-8(15)9(6,16)10(11,12)13/h2-4,16H,1H3,(H,14,15)/t9-/m0/s1 | | Definition date: | 2022-08-29 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (3S)-3-hydroxy-6-methyl-3-(trifluoromethyl)-1,3-dihydro-2H-indol-2-one |
|
 | | VNC | | Name: | methyl N-(benzenesulfonyl)-N-methylglycinate | | Formula: | C10 H13 N O4 S | | SMILES: | O=S(=O)(N(C)CC(=O)OC)c1ccccc1 | | InChi: | InChI=1S/C10H13NO4S/c1-11(8-10(12)15-2)16(13,14)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | methyl N-(benzenesulfonyl)-N-methylglycinate |
|
 | | VNU | | Name: | N-(1-phenylcyclobutyl)glycinamide | | Formula: | C12 H16 N2 O | | SMILES: | O=C(NC1(CCC1)c1ccccc1)CN | | InChi: | InChI=1S/C12H16N2O/c13-9-11(15)14-12(7-4-8-12)10-5-2-1-3-6-10/h1-3,5-6H,4,7-9,13H2,(H,14,15) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-(1-phenylcyclobutyl)glycinamide |
|
 | | VNX | | Name: | 5-cyclopropyl-2H-tetrazole | | Formula: | C4 H6 N4 | | SMILES: | C1CC1c1n[NH]nn1 | | InChi: | InChI=1S/C4H6N4/c1-2-3(1)4-5-7-8-6-4/h3H,1-2H2,(H,5,6,7,8) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 5-cyclopropyl-2H-tetrazole |
|
 | | VO5 | | Name: | N-ethyl-2-methoxybenzene-1-sulfonamide | | Formula: | C9 H13 N O3 S | | SMILES: | O=S(=O)(NCC)c1ccccc1OC | | InChi: | InChI=1S/C9H13NO3S/c1-3-10-14(11,12)9-7-5-4-6-8(9)13-2/h4-7,10H,3H2,1-2H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-ethyl-2-methoxybenzene-1-sulfonamide |
|
 | | VO9 | | Name: | N-cyclopropyl-N-(2-hydroxyethyl)thiophene-2-carboxamide | | Formula: | C10 H13 N O2 S | | SMILES: | O=C(N(CCO)C1CC1)c1cccs1 | | InChi: | InChI=1S/C10H13NO2S/c12-6-5-11(8-3-4-8)10(13)9-2-1-7-14-9/h1-2,7-8,12H,3-6H2 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-cyclopropyl-N-(2-hydroxyethyl)thiophene-2-carboxamide |
|
 | | VOE | | Name: | (2R)-2-phenylbutan-1-amine | | Formula: | C10 H15 N | | SMILES: | NCC(CC)c1ccccc1 | | InChi: | InChI=1S/C10H15N/c1-2-9(8-11)10-6-4-3-5-7-10/h3-7,9H,2,8,11H2,1H3/t9-/m0/s1 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (2R)-2-phenylbutan-1-amine |
|
 | | VOK | | Name: | 5,5-diethyl-1-methyl-1,3-diazinane-2,4,6-trione | | Formula: | C9 H14 N2 O3 | | SMILES: | O=C1NC(=O)N(C)C(=O)C1(CC)CC | | InChi: | InChI=1S/C9H14N2O3/c1-4-9(5-2)6(12)10-8(14)11(3)7(9)13/h4-5H2,1-3H3,(H,10,12,14) | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | 5,5-diethyl-1-methyl-1,3-diazinane-2,4,6-trione |
|
 | | VOQ | | Name: | N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,2-dimethyl-L-alaninamide | | Formula: | C11 H19 N3 O2 | | SMILES: | CN(Cc1c(C)onc1C)C(=O)C(C)(C)N | | InChi: | InChI=1S/C11H19N3O2/c1-7-9(8(2)16-13-7)6-14(5)10(15)11(3,4)12/h6,12H2,1-5H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,2-dimethyl-L-alaninamide |
|
 | | VOW | | Name: | (4-ethoxyphenyl)-oxidanyl-oxidanylidene-boron | | Formula: | C8 H11 B O3 | | SMILES: | CCOc1ccc(cc1)B(O)O | | InChi: | InChI=1S/C8H11BO3/c1-2-12-8-5-3-7(4-6-8)9(10)11/h3-6,10-11H,2H2,1H3 | | Definition date: | 2022-09-02 | | Last modified: | 2022-10-28 | | Release date: | 2022-11-02 | | Identifier: | (4-ethoxyphenyl)boronic acid |
|
