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PDB Info pages Status search Chemie search: 926 results BIRD

082

082
Name:	(5R)-5-(3-{[3-(6-methoxy-1,2-benzoxazol-3-yl)-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl]methyl}phenyl)-5-methyl-1,3-oxazolidine-2,4-dione
Formula:	C26 H20 N4 O6
SMILES:	O=C1NC(=O)OC1(c2cccc(c2)CN6c3ccccc3N(c5noc4cc(OC)ccc45)C6=O)C
InChi:	InChI=1S/C26H20N4O6/c1-26(23(31)27-24(32)35-26)16-7-5-6-15(12-16)14-29-19-8-3-4-9-20(19)30(25(29)33)22-18-11-10-17(34-2)13-21(18)36-28-22/h3-13H,14H2,1-2H3,(H,27,31,32)/t26-/m1/s1
Definition date:	2011-10-10
Last modified:	2011-11-18
Identifier:	(5R)-5-(3-{[3-(6-methoxy-1,2-benzoxazol-3-yl)-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl]methyl}phenyl)-5-methyl-1,3-oxazolidine-2,4-dione

41L

41L
Name:	N-(1H-benzimidazol-1-yl)-2-phenylacetamide
Formula:	C15 H13 N3 O
SMILES:	O=C(Nn1c2ccccc2nc1)Cc3ccccc3
InChi:	InChI=1S/C15H13N3O/c19-15(10-12-6-2-1-3-7-12)17-18-11-16-13-8-4-5-9-14(13)18/h1-9,11H,10H2,(H,17,19)
Definition date:	2010-11-19
Last modified:	2011-10-28
Identifier:	N-(1H-benzimidazol-1-yl)-2-phenylacetamide

EVE

EVE
Name:	1H-benzimidazole-2-sulfonamide
Formula:	C7 H7 N3 O2 S
SMILES:	O=S(=O)(c2nc1ccccc1n2)N
InChi:	InChI=1S/C7H7N3O2S/c8-13(11,12)7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H,9,10)(H2,8,11,12)
Definition date:	2011-06-03
Last modified:	2011-10-14
Identifier:	1H-benzimidazole-2-sulfonamide

6PP

6PP
Name:	3-[(2Z)-3-methylpent-2-en-1-yl]benzene-1,2-diol
Formula:	C12 H16 O2
SMILES:	Oc1c(cccc1O)C/C=C(/C)CC
InChi:	InChI=1S/C12H16O2/c1-3-9(2)7-8-10-5-4-6-11(13)12(10)14/h4-7,13-14H,3,8H2,1-2H3/b9-7-
Definition date:	2011-09-21
Last modified:	2011-10-07
Identifier:	3-[(2Z)-3-methylpent-2-en-1-yl]benzene-1,2-diol

MEX

MEX
Name:	1-(2,4-dihydroxyphenyl)-1,3-dihydro-2H-benzimidazol-2-one
Formula:	C13 H10 N2 O3
SMILES:	O=C2Nc1ccccc1N2c3ccc(O)cc3O
InChi:	InChI=1S/C13H10N2O3/c16-8-5-6-11(12(17)7-8)15-10-4-2-1-3-9(10)14-13(15)18/h1-7,16-17H,(H,14,18)
Definition date:	2010-09-20
Last modified:	2011-09-16
Identifier:	1-(2,4-dihydroxyphenyl)-1,3-dihydro-2H-benzimidazol-2-one

MEY

MEY
Name:	N-{[1-(5-chloro-2,4-dihydroxyphenyl)-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]methyl}naphthalene-1-sulfonamide
Formula:	C24 H18 Cl N3 O5 S
SMILES:	O=S(=O)(c2c1ccccc1ccc2)NCc3cc4c(cc3)N(C(=O)N4)c5cc(Cl)c(O)cc5O
InChi:	InChI=1S/C24H18ClN3O5S/c25-17-11-20(22(30)12-21(17)29)28-19-9-8-14(10-18(19)27-24(28)31)13-26-34(32,33)23-7-3-5-15-4-1-2-6-16(15)23/h1-12,26,29-30H,13H2,(H,27,31)
Definition date:	2010-09-21
Last modified:	2011-09-16
Identifier:	N-{[1-(5-chloro-2,4-dihydroxyphenyl)-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]methyl}naphthalene-1-sulfonamide

EV6

EV6
Name:	(3S)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)-N-[(1R,3S,5R,7R)-tricyclo[3.3.1.1~3,7~]dec-2-yl]pentanamide
Formula:	C22 H29 Cl N4 O
SMILES:	O=C(NC3C1CC2CC(C1)CC3C2)CC(n4c5ccc(Cl)cc5nc4N)CC
InChi:	InChI=1S/C22H29ClN4O/c1-2-17(27-19-4-3-16(23)10-18(19)25-22(27)24)11-20(28)26-21-14-6-12-5-13(8-14)9-15(21)7-12/h3-4,10,12-15,17,21H,2,5-9,11H2,1H3,(H2,24,25)(H,26,28)/t12-,13+,14-,15+,17-,21-/m0/s1
Definition date:	2010-05-03
Last modified:	2011-08-31
Identifier:	(3S)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)-N-[(1R,3S,5R,7R)-tricyclo[3.3.1.1~3,7~]dec-2-yl]pentanamide

0BB

0BB
Name:	4-{3-[(4-methyl-1-benzothiophen-3-yl)methyl]-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl}butanoic acid
Formula:	C21 H20 N2 O3 S
SMILES:	O=C(O)CCCN2c1ccccc1N(C2=O)Cc3c4c(cccc4sc3)C
InChi:	InChI=1S/C21H20N2O3S/c1-14-6-4-9-18-20(14)15(13-27-18)12-23-17-8-3-2-7-16(17)22(21(23)26)11-5-10-19(24)25/h2-4,6-9,13H,5,10-12H2,1H3,(H,24,25)
Definition date:	2011-05-23
Last modified:	2011-07-15
Identifier:	4-{3-[(4-methyl-1-benzothiophen-3-yl)methyl]-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl}butanoic acid

AXC

AXC
Name:	5-(1H-BENZIMIDAZOL-2-YLMETHYLSULFANYL)-2-METHYL-[1,2,4]TRIAZOLO[1,5-C]QUINAZOLINE
Formula:	C18 H14 N6 S
SMILES:	Cc1nn2c(SCc3[nH]c4ccccc4n3)nc5ccccc5c2n1
InChi:	InChI=1S/C18H14N6S/c1-11-19-17-12-6-2-3-7-13(12)22-18(24(17)23-11)25-10-16-20-14-8-4-5-9-15(14)21-16/h2-9H,10H2,1H3,(H,20,21)
Definition date:	2010-12-03
Last modified:	2011-06-10
Identifier:	5-(1H-benzimidazol-2-ylmethylsulfanyl)-2-methyl-[1,2,4]triazolo[1,5-c]quinazoline

T87

T87
Name:	[(1-{2[(4-CARBAMIMIDOYL-PHENYLAMINO)-METHYL]-1-METHYL-1H-BENZOIMIDAZOL-5-YL}-CYCLOPROPYL)-PYRIDIN-2-YL-METHYLENEAMINOOXY]-ACETIC ACID ETHYL ESTER
Formula:	C29 H31 N7 O3
SMILES:	O=C(OCC)CON=C(c1ncccc1)C5(c4ccc2c(nc(n2C)CNc3ccc(C(=[N@H])N)cc3)c4)CC5
InChi:	InChI=1S/C29H31N7O3/c1-3-38-26(37)18-39-35-27(22-6-4-5-15-32-22)29(13-14-29)20-9-12-24-23(16-20)34-25(36(24)2)17-33-21-10-7-19(8-11-21)28(30)31/h4-12,15-16,33H,3,13-14,17-18H2,1-2H3,(H3,30,31)/b35-27-
Definition date:	2000-11-22
Last modified:	2011-06-04
Identifier:	ethyl ({[(1E)-[1-(2-{[(4-carbamimidoylphenyl)amino]methyl}-1-methyl-1H-benzimidazol-5-yl)cyclopropyl](pyridin-2-yl)methylidene]amino}oxy)acetate

XYH

XYH
Name:	XYLAROHYDROXAMATE
Formula:	C5 H8 N O7
SMILES:	O=C(NO)C(O)C(O)C(O)C([O-])=O
InChi:	InChI=1S/C5H9NO7/c7-1(3(9)5(11)12)2(8)4(10)6-13/h1-3,7-9,13H,(H,6,10)(H,11,12)/p-1/t1-,2-,3+/m0/s1
Definition date:	2000-01-31
Last modified:	2011-06-04
Identifier:	(2R,3S,4S)-2,3,4-trihydroxy-5-(hydroxyamino)-5-oxopentanoate (non-preferred name)

YHO

YHO
Name:	(1S,2S,3R,4R)-4-aminocyclopentane-1,2,3-triol
Formula:	C5 H11 N O3
SMILES:	OC1CC(N)C(O)C1O
InChi:	InChI=1S/C5H11NO3/c6-2-1-3(7)5(9)4(2)8/h2-5,7-9H,1,6H2/t2-,3+,4-,5+/m1/s1
Definition date:	2008-07-25
Last modified:	2011-06-04
Identifier:	(1S,2S,3R,4R)-4-aminocyclopentane-1,2,3-triol

IOL

IOL
Name:	4-IODOPHENOL
Formula:	C6 H5 I O
SMILES:	Ic1ccc(O)cc1
InChi:	InChI=1S/C6H5IO/c7-5-1-3-6(8)4-2-5/h1-4,8H
Definition date:	2000-04-28
Last modified:	2011-06-04
Identifier:	4-iodophenol

XLI

XLI
Name:	N-acetyl-L-leucyl-N-[(4S,5S,7R)-8-(butylamino)-5-hydroxy-2,7-dimethyl-8-oxooctan-4-yl]-L-methioninamide
Formula:	C27 H52 N4 O5 S
SMILES:	O=C(NC(C(=O)NC(CC(C)C)C(O)CC(C(=O)NCCCC)C)CCSC)C(NC(=O)C)CC(C)C
InChi:	InChI=1S/C27H52N4O5S/c1-9-10-12-28-25(34)19(6)16-24(33)22(14-17(2)3)31-26(35)21(11-13-37-8)30-27(36)23(15-18(4)5)29-20(7)32/h17-19,21-24,33H,9-16H2,1-8H3,(H,28,34)(H,29,32)(H,30,36)(H,31,35)/t19-,21+,22+,23+,24+/m1/s1
Definition date:	2010-01-04
Last modified:	2011-06-04
Identifier:	N-acetyl-L-leucyl-N-[(4S,5S,7R)-8-(butylamino)-5-hydroxy-2,7-dimethyl-8-oxooctan-4-yl]-L-methioninamide

JZK

JZK
Name:	2-[(2-chlorobenzyl)amino]-1-(cyclohexylmethyl)-1H-benzimidazole-5-carboxamide
Formula:	C22 H25 Cl N4 O
SMILES:	Clc1ccccc1CNc3nc2cc(ccc2n3CC4CCCCC4)C(=O)N
InChi:	InChI=1S/C22H25ClN4O/c23-18-9-5-4-8-17(18)13-25-22-26-19-12-16(21(24)28)10-11-20(19)27(22)14-15-6-2-1-3-7-15/h4-5,8-12,15H,1-3,6-7,13-14H2,(H2,24,28)(H,25,26)
Definition date:	2009-09-29
Last modified:	2011-06-04
Identifier:	2-[(2-chlorobenzyl)amino]-1-(cyclohexylmethyl)-1H-benzimidazole-5-carboxamide

JZL

JZL
Name:	7-amino-2-[(2-chlorobenzyl)amino]-1-{[(1S,2S)-2-hydroxycycloheptyl]methyl}-1H-benzimidazole-5-carboxamide
Formula:	C23 H28 Cl N5 O2
SMILES:	Clc1ccccc1CNc3nc2cc(cc(c2n3CC4CCCCCC4O)N)C(=O)N
InChi:	InChI=1S/C23H28ClN5O2/c24-17-8-5-4-6-14(17)12-27-23-28-19-11-16(22(26)31)10-18(25)21(19)29(23)13-15-7-2-1-3-9-20(15)30/h4-6,8,10-11,15,20,30H,1-3,7,9,12-13,25H2,(H2,26,31)(H,27,28)/t15-,20-/m0/s1
Definition date:	2009-09-29
Last modified:	2011-06-04
Identifier:	7-amino-2-[(2-chlorobenzyl)amino]-1-{[(1S,2S)-2-hydroxycycloheptyl]methyl}-1H-benzimidazole-5-carboxamide

ISH

ISH
Name:	(7R)-7-[(dimethylamino)methyl]-1-[3-(dimethylamino)propyl]-7,8-dihydro-1H-furo[3,2-e]benzimidazol-2-amine
Formula:	C17 H27 N5 O
SMILES:	CN(C)CCCn1c(N)nc2ccc3O[CH](CN(C)C)Cc3c12
InChi:	InChI=1S/C17H27N5O/c1-20(2)8-5-9-22-16-13-10-12(11-21(3)4)23-15(13)7-6-14(16)19-17(22)18/h6-7,12H,5,8-11H2,1-4H3,(H2,18,19)/t12-/m1/s1
Definition date:	2010-02-25
Last modified:	2011-06-04
Identifier:	(7R)-7-(dimethylaminomethyl)-1-[3-(dimethylamino)propyl]-7,8-dihydrofuro[3,2-e]benzimidazol-2-amine

ISI

ISI
Name:	(7S)-7-[(dimethylamino)methyl]-1-[3-(dimethylamino)propyl]-7,8-dihydro-1H-furo[3,2-e]benzimidazol-2-amine
Formula:	C17 H27 N5 O
SMILES:	CN(C)CCCn1c(N)nc2ccc3O[CH](CN(C)C)Cc3c12
InChi:	InChI=1S/C17H27N5O/c1-20(2)8-5-9-22-16-13-10-12(11-21(3)4)23-15(13)7-6-14(16)19-17(22)18/h6-7,12H,5,8-11H2,1-4H3,(H2,18,19)/t12-/m0/s1
Definition date:	2010-02-17
Last modified:	2011-06-04
Identifier:	(7S)-7-(dimethylaminomethyl)-1-[3-(dimethylamino)propyl]-7,8-dihydrofuro[3,2-e]benzimidazol-2-amine

K11

K11
Name:	N-[4-({3-[2-(methylamino)pyrimidin-4-yl]pyridin-2-yl}oxy)naphthalen-1-yl]-6-(trifluoromethyl)-1H-benzimidazol-2-amine
Formula:	C28 H20 F3 N7 O
SMILES:	FC(F)(F)c6cc1c(nc(n1)Nc5c2ccccc2c(Oc4ncccc4c3nc(ncc3)NC)cc5)cc6
InChi:	InChI=1S/C28H20F3N7O/c1-32-26-34-14-12-21(35-26)19-7-4-13-33-25(19)39-24-11-10-20(17-5-2-3-6-18(17)24)36-27-37-22-9-8-16(28(29,30)31)15-23(22)38-27/h2-15H,1H3,(H,32,34,35)(H2,36,37,38)
Definition date:	2008-10-17
Last modified:	2011-06-04
Identifier:	N-[4-({3-[2-(methylamino)pyrimidin-4-yl]pyridin-2-yl}oxy)naphthalen-1-yl]-6-(trifluoromethyl)-1H-benzimidazol-2-amine

VGD

VGD
Name:	6-chloro-1H-benzimidazol-2-amine
Formula:	C7 H6 Cl N3
SMILES:	Clc2cc1c(nc(n1)N)cc2
InChi:	InChI=1S/C7H6ClN3/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H3,9,10,11)
Definition date:	2009-03-23
Last modified:	2011-06-04
Identifier:	6-chloro-1H-benzimidazol-2-amine

K17

K17
Name:	4,5,6,7-TETRABROMO-BENZIMIDAZOLE
Formula:	C7 H2 Br4 N2
SMILES:	Brc2c1c(ncn1)c(Br)c(Br)c2Br
InChi:	InChI=1S/C7H2Br4N2/c8-2-3(9)5(11)7-6(4(2)10)12-1-13-7/h1H,(H,12,13)
Definition date:	2007-03-12
Last modified:	2011-06-04
Identifier:	4,5,6,7-tetrabromo-1H-benzimidazole

VGF

VGF
Name:	1-(3,4-DICHLOROBENZYL)-7-PHENYL-1H-BENZIMIDAZOL-2-AMINE
Formula:	C20 H15 Cl2 N3
SMILES:	Clc1ccc(cc1Cl)Cn2c3c(nc2N)cccc3c4ccccc4
InChi:	InChI=1S/C20H15Cl2N3/c21-16-10-9-13(11-17(16)22)12-25-19-15(14-5-2-1-3-6-14)7-4-8-18(19)24-20(25)23/h1-11H,12H2,(H2,23,24)
Definition date:	2009-03-20
Last modified:	2011-06-04
Identifier:	1-(3,4-dichlorobenzyl)-7-phenyl-1H-benzimidazol-2-amine

V12

V12
Name:	5'-[(1H-BENZIMIDAZOL-2-YLACETYL)AMINO]-5'-DEOXYCYTIDINE
Formula:	C18 H20 N6 O5
SMILES:	O=C1N=C(N)C=CN1C2OC(C(O)C2O)CNC(=O)Cc3nc4ccccc4n3
InChi:	InChI=1S/C18H20N6O5/c19-12-5-6-24(18(28)23-12)17-16(27)15(26)11(29-17)8-20-14(25)7-13-21-9-3-1-2-4-10(9)22-13/h1-6,11,15-17,26-27H,7-8H2,(H,20,25)(H,21,22)(H2,19,23,28)/t11-,15-,16-,17-/m1/s1
Definition date:	2007-06-07
Last modified:	2011-06-04
Identifier:	5'-[(1H-benzimidazol-2-ylacetyl)amino]-5'-deoxycytidine

K22

K22
Name:	4,5,6,7-TETRABROMO-1H,3H-BENZIMIDAZOL-2-THIONE
Formula:	C7 H2 Br4 N2 S
SMILES:	Brc1c2c(c(Br)c(Br)c1Br)NC(=S)N2
InChi:	InChI=1S/C7H2Br4N2S/c8-1-2(9)4(11)6-5(3(1)10)12-7(14)13-6/h(H2,12,13,14)
Definition date:	2007-03-12
Last modified:	2011-06-04
Identifier:	4,5,6,7-tetrabromo-1,3-dihydro-2H-benzimidazole-2-thione

T12

T12
Name:	1-(3-HYDROXYPROPYL)-2-[(3-NITROBENZOYL)AMINO]-1H-BENZIMIDAZOL-5-YL PIVALATE
Formula:	C22 H24 N4 O6
SMILES:	[O-][N+](=O)c1cccc(c1)C(=O)Nc3nc2cc(OC(=O)C(C)(C)C)ccc2n3CCCO
InChi:	InChI=1S/C22H24N4O6/c1-22(2,3)20(29)32-16-8-9-18-17(13-16)23-21(25(18)10-5-11-27)24-19(28)14-6-4-7-15(12-14)26(30)31/h4,6-9,12-13,27H,5,10-11H2,1-3H3,(H,23,24,28)
Definition date:	2006-11-07
Last modified:	2011-06-04
Identifier:	1-(3-hydroxypropyl)-2-{[(3-nitrophenyl)carbonyl]amino}-1H-benzimidazol-5-yl 2,2-dimethylpropanoate

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