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45C

45C
Name:	4,5-dichlorobenzene-1,2-diol
Formula:	C6 H4 Cl2 O2
SMILES:	Clc1cc(O)c(O)cc1Cl
InChi:	InChI=1S/C6H4Cl2O2/c7-3-1-5(9)6(10)2-4(3)8/h1-2,9-10H
Definition date:	2009-07-09
Last modified:	2011-06-04
Identifier:	4,5-dichlorobenzene-1,2-diol

A2C

A2C
Name:	3,3'-[ethane-1,2-diylbis(nitrilomethylylidene)]bis(4-hydroxybenzenecarboximidamide)
Formula:	C18 H20 N6 O2
SMILES:	NC(=N)c1ccc(O)c(C=NCCN=Cc2cc(ccc2O)C(N)=N)c1
InChi:	InChI=1S/C18H20N6O2/c19-17(20)11-1-3-15(25)13(7-11)9-23-5-6-24-10-14-8-12(18(21)22)2-4-16(14)26/h1-4,7-10,25-26H,5-6H2,(H3,19,20)(H3,21,22)
Definition date:	2009-12-03
Last modified:	2011-06-04
Identifier:	3-[2-[(5-carbamimidoyl-2-hydroxy-phenyl)methylideneamino]ethyliminomethyl]-4-hydroxy-benzenecarboximidamide

FB1

FB1
Name:	2-CHLOROBENZENESULFONAMIDE
Formula:	C6 H6 Cl N O2 S
SMILES:	O=S(=O)(c1ccccc1Cl)N
InChi:	InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)
Definition date:	2009-03-31
Last modified:	2011-06-04
Identifier:	2-chlorobenzenesulfonamide

FB2

FB2
Name:	benzenesulfonamide
Formula:	C6 H7 N O2 S
SMILES:	O=S(=O)(N)c1ccccc1
InChi:	InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9)
Definition date:	2009-03-31
Last modified:	2011-06-04
Identifier:	benzenesulfonamide

FBT

FBT
Name:	2,6-DIFLUOROBENZENESULFONAMIDE
Formula:	C6 H5 F2 N O2 S
SMILES:	O=S(=O)(c1c(F)cccc1F)N
InChi:	InChI=1S/C6H5F2NO2S/c7-4-2-1-3-5(8)6(4)12(9,10)11/h1-3H,(H2,9,10,11)
Definition date:	2001-04-16
Last modified:	2011-06-04
Identifier:	2,6-difluorobenzenesulfonamide

FBU

FBU
Name:	3,5-DIFLUOROBENZENESULFONAMIDE
Formula:	C6 H5 F2 N O2 S
SMILES:	Fc1cc(cc(F)c1)S(=O)(=O)N
InChi:	InChI=1S/C6H5F2NO2S/c7-4-1-5(8)3-6(2-4)12(9,10)11/h1-3H,(H2,9,10,11)
Definition date:	2001-04-16
Last modified:	2011-06-04
Identifier:	3,5-difluorobenzenesulfonamide

FBV

FBV
Name:	2-fluorobenzenesulfonamide
Formula:	C6 H6 F N O2 S
SMILES:	O=S(=O)(c1ccccc1F)N
InChi:	InChI=1S/C6H6FNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)
Definition date:	2009-03-31
Last modified:	2011-06-04
Identifier:	2-fluorobenzenesulfonamide

FBW

FBW
Name:	3-fluorobenzenesulfonamide
Formula:	C6 H6 F N O2 S
SMILES:	O=S(=O)(c1cc(F)ccc1)N
InChi:	InChI=1S/C6H6FNO2S/c7-5-2-1-3-6(4-5)11(8,9)10/h1-4H,(H2,8,9,10)
Definition date:	2009-04-01
Last modified:	2011-06-04
Identifier:	3-fluorobenzenesulfonamide

4BH

4BH
Name:	4-CHLORO-6-(4-PIPERAZIN-1-YL-1H-PYRAZOL-5-YL)BENZENE-1,3-DIOL
Formula:	C13 H15 Cl N4 O2
SMILES:	Clc1cc(c(O)cc1O)c2c(cnn2)N3CCNCC3
InChi:	InChI=1S/C13H15ClN4O2/c14-9-5-8(11(19)6-12(9)20)13-10(7-16-17-13)18-3-1-15-2-4-18/h5-7,15,19-20H,1-4H2,(H,16,17)
Definition date:	2006-01-18
Last modified:	2011-06-04
Identifier:	4-chloro-6-(4-piperazin-1-yl-1H-pyrazol-5-yl)benzene-1,3-diol

4BZ

4BZ
Name:	4-(HYDROXYMETHYL)BENZAMIDINE
Formula:	C8 H10 N2 O
SMILES:	OCc1ccc(C(=[N@H])N)cc1
InChi:	InChI=1S/C8H10N2O/c9-8(10)7-3-1-6(5-11)2-4-7/h1-4,11H,5H2,(H3,9,10)
Definition date:	2004-01-26
Last modified:	2011-06-04
Identifier:	4-(hydroxymethyl)benzenecarboximidamide

FD3

FD3
Name:	N-ALPHA-(2-NAPHTHYLSULFONYL)-3-AMIDINO-L-PHENYLALANINE PIPERAZIDE
Formula:	C24 H27 N5 O3 S
SMILES:	O=C(N1CCNCC1)C(NS(=O)(=O)c3cc2ccccc2cc3)Cc4cc(C(=[N@H])N)ccc4
InChi:	InChI=1S/C24H27N5O3S/c25-23(26)20-7-3-4-17(14-20)15-22(24(30)29-12-10-27-11-13-29)28-33(31,32)21-9-8-18-5-1-2-6-19(18)16-21/h1-9,14,16,22,27-28H,10-13,15H2,(H3,25,26)/t22-/m0/s1
Definition date:	2001-10-19
Last modified:	2011-06-04
Identifier:	3-{(2S)-2-[(naphthalen-2-ylsulfonyl)amino]-3-oxo-3-piperazin-1-ylpropyl}benzenecarboximidamide

FD4

FD4
Name:	N-ALPHA-(2-NAPHTHYLSULFONYL)-N(3-AMIDINO-L-PHENYLALANINYL)-4-ACETYL-PIPERAZINE
Formula:	C26 H29 N5 O4 S
SMILES:	O=C(N4CCN(C(=O)C(NS(=O)(=O)c2cc1ccccc1cc2)Cc3cc(C(=[N@H])N)ccc3)CC4)C
InChi:	InChI=1S/C26H29N5O4S/c1-18(32)30-11-13-31(14-12-30)26(33)24(16-19-5-4-8-22(15-19)25(27)28)29-36(34,35)23-10-9-20-6-2-3-7-21(20)17-23/h2-10,15,17,24,29H,11-14,16H2,1H3,(H3,27,28)/t24-/m0/s1
Definition date:	2001-10-19
Last modified:	2011-06-04
Identifier:	3-{(2S)-3-(4-acetylpiperazin-1-yl)-2-[(naphthalen-2-ylsulfonyl)amino]-3-oxopropyl}benzenecarboximidamide

4CD

4CD
Name:	4-chloro-6-{[(2R)-2-(2-methylphenyl)pyrrolidin-1-yl]carbonyl}benzene-1,3-diol
Formula:	C18 H18 Cl N O3
SMILES:	O=C(c1cc(Cl)c(O)cc1O)N3C(c2c(cccc2)C)CCC3
InChi:	InChI=1S/C18H18ClNO3/c1-11-5-2-3-6-12(11)15-7-4-8-20(15)18(23)13-9-14(19)17(22)10-16(13)21/h2-3,5-6,9-10,15,21-22H,4,7-8H2,1H3/t15-/m1/s1
Definition date:	2009-10-22
Last modified:	2011-06-04
Identifier:	(5-chloro-2,4-dihydroxyphenyl)[(2R)-2-(2-methylphenyl)pyrrolidin-1-yl]methanone

4CL

4CL
Name:	4-CHLOROBENZENE-1,2-DIOL
Formula:	C6 H5 Cl O2
SMILES:	Clc1cc(O)c(O)cc1
InChi:	InChI=1S/C6H5ClO2/c7-4-1-2-5(8)6(9)3-4/h1-3,8-9H
Definition date:	2007-06-18
Last modified:	2011-06-04
Identifier:	4-chlorobenzene-1,2-diol

FEP

FEP
Name:	[(4-{4-[4-(DIFLUORO-PHOSPHONO-METHYL)-PHENYL]-BUTYL}-PHENYL)-DIFLUORO-METHYL]-PHOSPHONIC ACID
Formula:	C18 H20 F4 O6 P2
SMILES:	FC(F)(c1ccc(cc1)CCCCc2ccc(cc2)C(F)(F)P(=O)(O)O)P(=O)(O)O
InChi:	InChI=1S/C18H20F4O6P2/c19-17(20,29(23,24)25)15-9-5-13(6-10-15)3-1-2-4-14-7-11-16(12-8-14)18(21,22)30(26,27)28/h5-12H,1-4H2,(H2,23,24,25)(H2,26,27,28)
Definition date:	2001-11-06
Last modified:	2011-06-04
Identifier:	{butane-1,4-diylbis[benzene-4,1-diyl(difluoromethanediyl)]}bis(phosphonic acid)

4EB

4EB
Name:	4-({2-[(2,4-DIMETHYLPHENYL)SULFANYL]ETHYL}AMINO)-N-[(4'-FLUORO-1,1'-BIPHENYL-4-YL)CARBONYL]-3-NITROBENZENESULFONAMIDE
Formula:	C29 H26 F N3 O5 S2
SMILES:	Fc1ccc(cc1)c2ccc(cc2)C(=O)NS(=O)(=O)c3ccc(c([N+]([O-])=O)c3)NCCSc4ccc(cc4C)C
InChi:	InChI=1S/C29H26FN3O5S2/c1-19-3-14-28(20(2)17-19)39-16-15-31-26-13-12-25(18-27(26)33(35)36)40(37,38)32-29(34)23-6-4-21(5-7-23)22-8-10-24(30)11-9-22/h3-14,17-18,31H,15-16H2,1-2H3,(H,32,34)
Definition date:	2005-03-09
Last modified:	2011-06-04
Identifier:	N-{[4-({2-[(2,4-dimethylphenyl)sulfanyl]ethyl}amino)-3-nitrophenyl]sulfonyl}-4'-fluorobiphenyl-4-carboxamide

A37

A37
Name:	2,5-DICHLORO-N-(5-CHLORO-1,3-BENZOXAZOL-2-YL)BENZENESULFONAMIDE
Formula:	C13 H7 Cl3 N2 O3 S
SMILES:	Clc1cc(c(Cl)cc1)S(=O)(=O)Nc2nc3cc(Cl)ccc3o2
InChi:	InChI=1S/C13H7Cl3N2O3S/c14-7-2-4-11-10(5-7)17-13(21-11)18-22(19,20)12-6-8(15)1-3-9(12)16/h1-6H,(H,17,18)
Definition date:	2006-01-25
Last modified:	2011-06-04
Identifier:	2,5-dichloro-N-(5-chloro-1,3-benzoxazol-2-yl)benzenesulfonamide

1MS

1MS
Name:	N-[(4-methylpyrimidin-2-yl)carbamoyl]-2-nitrobenzenesulfonamide
Formula:	C12 H11 N5 O5 S
SMILES:	O=C(Nc1nc(ccn1)C)NS(=O)(=O)c2ccccc2[N+]([O-])=O
InChi:	InChI=1S/C12H11N5O5S/c1-8-6-7-13-11(14-8)15-12(18)16-23(21,22)10-5-3-2-4-9(10)17(19)20/h2-7H,1H3,(H2,13,14,15,16,18)
Definition date:	2008-10-06
Last modified:	2011-06-04
Identifier:	N-[(4-methylpyrimidin-2-yl)carbamoyl]-2-nitrobenzenesulfonamide

A74

A74
Name:	2,5-DICHLORO-N-[5-METHOXY-7-(6-METHOXYPYRIDIN-3-YL)-1,3-BENZOXAZOL-2-YL]BENZENESULFONAMIDE
Formula:	C20 H15 Cl2 N3 O5 S
SMILES:	Clc1cc(c(Cl)cc1)S(=O)(=O)Nc2nc3cc(OC)cc(c3o2)c4ccc(OC)nc4
InChi:	InChI=1S/C20H15Cl2N3O5S/c1-28-13-8-14(11-3-6-18(29-2)23-10-11)19-16(9-13)24-20(30-19)25-31(26,27)17-7-12(21)4-5-15(17)22/h3-10H,1-2H3,(H,24,25)
Definition date:	2006-01-25
Last modified:	2011-06-04
Identifier:	2,5-dichloro-N-[5-methoxy-7-(6-methoxypyridin-3-yl)-1,3-benzoxazol-2-yl]benzenesulfonamide

194

194
Name:	4-{2-[(3-NITROBENZOYL)AMINO]PHENOXY}PHTHALIC ACID
Formula:	C21 H14 N2 O8
SMILES:	[O-][N+](=O)c1cccc(c1)C(=O)Nc3ccccc3Oc2ccc(C(=O)O)c(C(=O)O)c2
InChi:	InChI=1S/C21H14N2O8/c24-19(12-4-3-5-13(10-12)23(29)30)22-17-6-1-2-7-18(17)31-14-8-9-15(20(25)26)16(11-14)21(27)28/h1-11H,(H,22,24)(H,25,26)(H,27,28)
Definition date:	2005-03-29
Last modified:	2011-06-04
Identifier:	4-(2-{[(3-nitrophenyl)carbonyl]amino}phenoxy)benzene-1,2-dicarboxylic acid

195

195
Name:	4-{2,4-BIS[(3-NITROBENZOYL)AMINO]PHENOXY}PHTHALIC ACID
Formula:	C28 H18 N4 O11
SMILES:	[O-][N+](=O)c1cccc(c1)C(=O)Nc3ccc(Oc2ccc(C(=O)O)c(C(=O)O)c2)c(c3)NC(=O)c4cccc([N+]([O-])=O)c4
InChi:	InChI=1S/C28H18N4O11/c33-25(15-3-1-5-18(11-15)31(39)40)29-17-7-10-24(43-20-8-9-21(27(35)36)22(14-20)28(37)38)23(13-17)30-26(34)16-4-2-6-19(12-16)32(41)42/h1-14H,(H,29,33)(H,30,34)(H,35,36)(H,37,38)
Definition date:	2005-03-29
Last modified:	2011-06-04
Identifier:	4-(2,4-bis{[(3-nitrophenyl)carbonyl]amino}phenoxy)benzene-1,2-dicarboxylic acid

1AF

1AF
Name:	2,4-BIS{[4-(N-CYCLOPENTYLDIAMINOMETHYL)PHENYL]}FURAN
Formula:	C28 H36 N4 O
SMILES:	o3c(cc(c1ccc(cc1)C(N)NC2CCCC2)c3)c4ccc(cc4)C(N)NC5CCCC5
InChi:	InChI=1S/C28H36N4O/c29-27(31-24-5-1-2-6-24)21-13-9-19(10-14-21)23-17-26(33-18-23)20-11-15-22(16-12-20)28(30)32-25-7-3-4-8-25/h9-18,24-25,27-28,31-32H,1-8,29-30H2/t27-,28-/m0/s1
Definition date:	2006-05-09
Last modified:	2011-06-04
Identifier:	(S,S)-(furan-2,4-diyldibenzene-4,1-diyl)bis(N-cyclopentylmethanediamine)

A94

A94
Name:	N-[(2-AMINO-6-METHYLPYRIMIDIN-4-YL)METHYL]-3-{[(E)-(2-OXODIHYDROFURAN-3(2H)-YLIDENE)METHYL]AMINO}BENZENESULFONAMIDE
Formula:	C17 H19 N5 O4 S
SMILES:	O=S(=O)(NCc1nc(nc(c1)C)N)c3cc(NC=C2C(=O)OCC2)ccc3
InChi:	InChI=1S/C17H19N5O4S/c1-11-7-14(22-17(18)21-11)10-20-27(24,25)15-4-2-3-13(8-15)19-9-12-5-6-26-16(12)23/h2-4,7-9,19-20H,5-6,10H2,1H3,(H2,18,21,22)/b12-9+
Definition date:	2007-07-05
Last modified:	2011-06-04
Identifier:	N-[(2-amino-6-methylpyrimidin-4-yl)methyl]-3-{[(E)-(2-oxodihydrofuran-3(2H)-ylidene)methyl]amino}benzenesulfonamide

AAS

AAS
Name:	3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDE
Formula:	C8 H10 Hg N2 O4 S
SMILES:	O=S(=O)(c1cc([Hg]OC(=O)C)c(N)cc1)N
InChi:	InChI=1S/C6H7N2O2S.C2H4O2.Hg/c7-5-1-3-6(4-2-5)11(8,9)10
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	(acetato-kappaO)(2-amino-5-sulfamoylphenyl)mercury

AAX

AAX
Name:	N-(CYCLOPROPYLMETHYL)-4-(METHYLOXY)-3-({5-[3-(3-PYRIDINYL)PHENYL]-1,3-OXAZOL-2-YL}AMINO)BENZENESULFONAMIDE
Formula:	C25 H24 N4 O4 S
SMILES:	O=S(=O)(NCC1CC1)c2cc(c(OC)cc2)Nc3ncc(o3)c5cccc(c4cccnc4)c5
InChi:	InChI=1S/C25H24N4O4S/c1-32-23-10-9-21(34(30,31)28-14-17-7-8-17)13-22(23)29-25-27-16-24(33-25)19-5-2-4-18(12-19)20-6-3-11-26-15-20/h2-6,9-13,15-17,28H,7-8,14H2,1H3,(H,27,29)
Definition date:	2004-12-09
Last modified:	2011-06-04
Identifier:	N-(cyclopropylmethyl)-4-methoxy-3-{[5-(3-pyridin-3-ylphenyl)-1,3-oxazol-2-yl]amino}benzenesulfonamide

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