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BPX

BPX
Name:	(2R)-4,4-dihydroxy-5-nitro-2-(phenylmethyl)pentanoic acid
Formula:	C12 H15 N O6
SMILES:	[O-][N+](=O)CC(O)(O)CC(C(=O)O)Cc1ccccc1
InChi:	InChI=1S/C12H15NO6/c14-11(15)10(6-9-4-2-1-3-5-9)7-12(16,17)8-13(18)19/h1-5,10,16-17H,6-8H2,(H,14,15)/t10-/m1/s1
Definition date:	2009-01-22
Last modified:	2011-06-04
Identifier:	(2R)-2-benzyl-4,4-dihydroxy-5-nitropentanoic acid

BPY

BPY
Name:	BIPHENYL-2,3-DIOL
Formula:	C12 H10 O2
SMILES:	Oc2c(c1ccccc1)cccc2O
InChi:	InChI=1S/C12H10O2/c13-11-8-4-7-10(12(11)14)9-5-2-1-3-6-9/h1-8,13-14H
Definition date:	2000-03-01
Last modified:	2011-06-04
Identifier:	biphenyl-2,3-diol

BQM

BQM
Name:	3-({4-[(1E)-3-morpholin-4-yl-3-oxoprop-1-en-1-yl]-2,3-bis(trifluoromethyl)phenyl}sulfanyl)aniline
Formula:	C21 H18 F6 N2 O2 S
SMILES:	O=C(C=Cc2ccc(Sc1cc(N)ccc1)c(c2C(F)(F)F)C(F)(F)F)N3CCOCC3
InChi:	InChI=1S/C21H18F6N2O2S/c22-20(23,24)18-13(5-7-17(30)29-8-10-31-11-9-29)4-6-16(19(18)21(25,26)27)32-15-3-1-2-14(28)12-15/h1-7,12H,8-11,28H2/b7-5+
Definition date:	2008-01-03
Last modified:	2011-06-04
Identifier:	3-({4-[(1E)-3-morpholin-4-yl-3-oxoprop-1-en-1-yl]-2,3-bis(trifluoromethyl)phenyl}sulfanyl)aniline

BQN

BQN
Name:	4-{(2E)-3-[4-{[2-(pyridin-3-ylmethoxy)phenyl]sulfanyl}-2,3-bis(trifluoromethyl)phenyl]prop-2-enoyl}morpholine
Formula:	C27 H22 F6 N2 O3 S
SMILES:	O=C(C=Cc3ccc(Sc2ccccc2OCc1cccnc1)c(c3C(F)(F)F)C(F)(F)F)N4CCOCC4
InChi:	InChI=1S/C27H22F6N2O3S/c28-26(29,30)24-19(8-10-23(36)35-12-14-37-15-13-35)7-9-22(25(24)27(31,32)33)39-21-6-2-1-5-20(21)38-17-18-4-3-11-34-16-18/h1-11,16H,12-15,17H2/b10-8+
Definition date:	2008-01-03
Last modified:	2011-06-04
Identifier:	4-{(2E)-3-[4-{[2-(pyridin-3-ylmethoxy)phenyl]sulfanyl}-2,3-bis(trifluoromethyl)phenyl]prop-2-enoyl}morpholine

BR6

BR6
Name:	(E)-4-((4-bromophenylimino)methyl)benzimidamide
Formula:	C14 H12 Br N3
SMILES:	Brc2ccc(/N=C/c1ccc(C(=[N@H])N)cc1)cc2
InChi:	InChI=1S/C14H12BrN3/c15-12-5-7-13(8-6-12)18-9-10-1-3-11(4-2-10)14(16)17/h1-9H,(H3,16,17)/b18-9+
Definition date:	2009-10-13
Last modified:	2011-06-04
Identifier:	4-{(E)-[(4-bromophenyl)imino]methyl}benzenecarboximidamide

BRB

BRB
Name:	PARA-BROMOBENZYL ALCOHOL
Formula:	C7 H7 Br O
SMILES:	Brc1ccc(cc1)CO
InChi:	InChI=1S/C7H7BrO/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	(4-bromophenyl)methanol

BRC

BRC
Name:	12-BROMODODECANOIC ACID
Formula:	C12 H23 Br O2
SMILES:	BrCCCCCCCCCCCC(=O)O
InChi:	InChI=1S/C12H23BrO2/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h1-11H2,(H,14,15)
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	12-bromododecanoic acid

BRD

BRD
Name:	1-BETA-RIBOFURANOSYL-1,3-DIAZEPINONE
Formula:	C10 H14 N2 O5
SMILES:	O=C1NC=CC=CN1C2OC(C(O)C2O)CO
InChi:	InChI=1S/C10H14N2O5/c13-5-6-7(14)8(15)9(17-6)12-4-2-1-3-11-10(12)16/h1-4,6-9,13-15H,5H2,(H,11,16)/t6-,7-,8-,9-/m1/s1
Definition date:	2002-09-17
Last modified:	2011-06-04
Identifier:	1-beta-D-ribofuranosyl-1,3-dihydro-2H-1,3-diazepin-2-one

BRG

BRG
Name:	8-BROMOGUANINE
Formula:	C5 H4 Br N5 O
SMILES:	O=C2NC(=Nc1nc(Br)nc12)N
InChi:	InChI=1S/C5H4BrN5O/c6-4-8-1-2(9-4)10-5(7)11-3(1)12/h(H4,7,8,9,10,11,12)
Definition date:	2002-06-14
Last modified:	2011-06-04
Identifier:	2-amino-8-bromo-1,7-dihydro-6H-purin-6-one

BRQ

BRQ
Name:	{[4-AMINO-2-(3-CHLOROANILINO)-1,3-THIAZOL-5-YL](4-FLUOROPHENYL)METHANONE
Formula:	C16 H12 Cl F N3 O S
SMILES:	Fc1ccc(cc1)C(=O)c3sc(Nc2cc(Cl)ccc2)[nH+]c3N
InChi:	InChI=1S/C16H11ClFN3OS/c17-10-2-1-3-12(8-10)20-16-21-15(19)14(23-16)13(22)9-4-6-11(18)7-5-9/h1-8H,19H2,(H,20,21)/p+1
Definition date:	2006-07-26
Last modified:	2011-06-04
Identifier:	4-amino-2-[(3-chlorophenyl)amino]-5-[(4-fluorophenyl)carbonyl]-1,3-thiazol-3-ium

BRT

BRT
Name:	5-BROMONICOTINAMIDE
Formula:	C6 H5 Br N2 O
SMILES:	O=C(c1cncc(Br)c1)N
InChi:	InChI=1S/C6H5BrN2O/c7-5-1-4(6(8)10)2-9-3-5/h1-3H,(H2,8,10)
Definition date:	2002-04-15
Last modified:	2011-06-04
Identifier:	5-bromopyridine-3-carboxamide

BRU

BRU
Name:	5-BROMO-2'-DEOXYURIDINE-5'-MONOPHOSPHATE
Formula:	C9 H12 Br N2 O8 P
SMILES:	BrC=1C(=O)NC(=O)N(C=1)C2OC(C(O)C2)COP(=O)(O)O
InChi:	InChI=1S/C9H12BrN2O8P/c10-4-2-12(9(15)11-8(4)14)7-1-5(13)6(20-7)3-19-21(16,17)18/h2,5-7,13H,1,3H2,(H,11,14,15)(H2,16,17,18)/t5-,6+,7+/m0/s1
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	5-bromo-2'-deoxyuridine 5'-(dihydrogen phosphate)

BRX

BRX
Name:	BROMAMPHENICOL
Formula:	C11 H12 Br2 N2 O5
SMILES:	BrC(Br)C(=O)NC(C(O)c1ccc([N+]([O-])=O)cc1)CO
InChi:	InChI=1S/C11H12Br2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m1/s1
Definition date:	2008-08-28
Last modified:	2011-06-04
Identifier:	2,2-dibromo-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-(4-nitrophenyl)ethyl]acetamide

BRY

BRY
Name:	(2Z)-5'-BROMO-2,3'-BIINDOLE-2',3(1H,1'H)-DIONE AMMONIATE
Formula:	C16 H9 Br N2 O2
SMILES:	O=C/4c1ccccc1NC4=C3/c2cc(Br)ccc2NC3=O
InChi:	InChI=1S/C16H9BrN2O2/c17-8-5-6-12-10(7-8)13(16(21)19-12)14-15(20)9-3-1-2-4-11(9)18-14/h1-7,18H,(H,19,21)/b14-13-
Definition date:	2005-01-10
Last modified:	2011-06-04
Identifier:	(2Z)-5'-bromo-2,3'-biindole-2',3(1H,1'H)-dione

BS1

BS1
Name:	(3-EXO)-3-(10,11-DIHYDRO-5H-DIBENZO[A,D][7]ANNULEN-5-YLOXY)-8,8-DIMETHYL-8-AZONIABICYCLO[3.2.1]OCTANE
Formula:	C24 H30 N O
SMILES:	O(C3c1ccccc1CCc2ccccc23)C5CC4[N+](C)(C(CC4)C5)C
InChi:	InChI=1S/C24H30NO/c1-25(2)19-13-14-20(25)16-21(15-19)26-24-22-9-5-3-7-17(22)11-12-18-8-4-6-10-23(18)24/h3-10,19-21,24H,11-16H2,1-2H3/q+1/t19-,20+,21-
Definition date:	2009-01-16
Last modified:	2011-06-04
Identifier:	(3-exo)-3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-yloxy)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octane

BS2

BS2
Name:	(3-ENDO,8-ANTI)-8-BENZYL-3-(10,11-DIHYDRO-5H-DIBENZO[A,D][7]ANNULEN-5-YLOXY)-8-AZONIABICYCLO[3.2.1]OCTANE
Formula:	C29 H32 N O
SMILES:	O(C3c1ccccc1CCc2ccccc23)C6CC5[NH+](Cc4ccccc4)C(CC5)C6
InChi:	InChI=1S/C29H31NO/c1-2-8-21(9-3-1)20-30-24-16-17-25(30)19-26(18-24)31-29-27-12-6-4-10-22(27)14-15-23-11-5-7-13-28(23)29/h1-13,24-26,29H,14-20H2/p+1/t24-,25+,26+
Definition date:	2009-01-16
Last modified:	2011-06-04
Identifier:	(3-endo,8-anti)-8-benzyl-3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-yloxy)-8-azoniabicyclo[3.2.1]octane

BSA

BSA
Name:	2-(BENZOYLAMINO)ETHANESULFONIC ACID
Formula:	C9 H11 N O4 S
SMILES:	O=C(NCCS(=O)(=O)O)c1ccccc1
InChi:	InChI=1S/C9H11NO4S/c11-9(8-4-2-1-3-5-8)10-6-7-15(12,13)14/h1-5H,6-7H2,(H,10,11)(H,12,13,14)
Definition date:	2005-02-11
Last modified:	2011-06-04
Identifier:	2-[(phenylcarbonyl)amino]ethanesulfonic acid

BSB

BSB
Name:	N-BENZYL-4-SULFAMOYL-BENZAMIDE
Formula:	C14 H14 N2 O3 S
SMILES:	O=S(=O)(N)c2ccc(C(=O)NCc1ccccc1)cc2
InChi:	InChI=1S/C14H14N2O3S/c15-20(18,19)13-8-6-12(7-9-13)14(17)16-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,16,17)(H2,15,18,19)
Definition date:	2000-10-30
Last modified:	2011-06-04
Identifier:	N-benzyl-4-sulfamoylbenzamide

BSF

BSF
Name:	{[(benzylsulfonyl)amino]methyl}boronic acid
Formula:	C8 H12 B N O4 S
SMILES:	O=S(=O)(NCB(O)O)Cc1ccccc1
InChi:	InChI=1S/C8H12BNO4S/c11-9(12)7-10-15(13,14)6-8-4-2-1-3-5-8/h1-5,10-12H,6-7H2
Definition date:	2010-08-03
Last modified:	2011-06-04
Identifier:	{[(benzylsulfonyl)amino]methyl}boronic acid

BSG

BSG
Name:	4-({[(dihydroxyboranyl)methyl]sulfamoyl}methyl)benzoic acid
Formula:	C9 H12 B N O6 S
SMILES:	O=S(=O)(NCB(O)O)Cc1ccc(cc1)C(=O)O
InChi:	InChI=1S/C9H12BNO6S/c12-9(13)8-3-1-7(2-4-8)5-18(16,17)11-6-10(14)15/h1-4,11,14-15H,5-6H2,(H,12,13)
Definition date:	2010-08-03
Last modified:	2011-06-04
Identifier:	4-({[(dihydroxyboranyl)methyl]sulfamoyl}methyl)benzoic acid

BSH

BSH
Name:	3-[(2R)-2-[(benzylsulfonyl)amino]-2-(dihydroxyboranyl)ethyl]benzoic acid
Formula:	C16 H18 B N O6 S
SMILES:	O=S(=O)(NC(B(O)O)Cc1cccc(C(=O)O)c1)Cc2ccccc2
InChi:	InChI=1S/C16H18BNO6S/c19-16(20)14-8-4-7-13(9-14)10-15(17(21)22)18-25(23,24)11-12-5-2-1-3-6-12/h1-9,15,18,21-22H,10-11H2,(H,19,20)/t15-/m0/s1
Definition date:	2010-08-03
Last modified:	2011-06-04
Identifier:	3-[(2R)-2-[(benzylsulfonyl)amino]-2-(dihydroxyboranyl)ethyl]benzoic acid

BSI

BSI
Name:	2-(BIPHENYL-4-SULFONYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID
Formula:	C22 H19 N O4 S
SMILES:	O=S(=O)(c2ccc(c1ccccc1)cc2)N4C(C(=O)O)Cc3c(cccc3)C4
InChi:	InChI=1S/C22H19NO4S/c24-22(25)21-14-18-8-4-5-9-19(18)15-23(21)28(26,27)20-12-10-17(11-13-20)16-6-2-1-3-7-16/h1-13,21H,14-15H2,(H,24,25)/t21-/m1/s1
Definition date:	1999-08-04
Last modified:	2011-06-04
Identifier:	(3R)-2-(biphenyl-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

BSJ

BSJ
Name:	(3R,9Z)-17-[(2R,3S,4R,5R,6R)-5-amino-6-{[(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl]oxy}-3,4-dihydroxytetrahydro-2H-pyran-2-yl]-3-hydroxy-2,2-dimethyl-4,8,15-trioxo-12-thia-5,9,16-triazaheptadec-9-en-1-yl [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl dihydrogen diphosphate
Formula:	C36 H62 N11 O23 P3 S
SMILES:	O=P(O)(O)OC1C(O)C(OC1COP(=O)(O)OP(=O)(O)OCC(C)(C)C(O)C(=O)NCCC(=O)N=C/CSCCC(=O)NCC3OC(OC2C(O)C(O)C(N)CC2N)C(N)C(O)C3O)n4c5ncnc(N)c5nc4
InChi:	InChI=1S/C36H62N11O23P3S/c1-36(2,12-65-73(62,63)70-72(60,61)64-11-18-29(69-71(57,58)59)27(54)34(66-18)47-14-46-22-31(40)44-13-45-32(22)47)30(55)33(56)42-5-3-19(48)41-6-8-74-7-4-20(49)43-10-17-24(51)25(52)21(39)35(67-17)68-28-16(38)9-15(37)23(50)26(28)53/h6,13-18,21,23-30,34-35,50-55H,3-5,7-12,37-39H2,1-2H3,(H,42,56)(H,43,49)(H,60,61)(H,62,63)(H2,40,44,45)(H2,57,58,59)/b41-6-/t15-,16+,17-,18-,21-,23+,24-,25-,26-,27-,28-,29-,30+,34-,35-/m1/s1
Definition date:	2007-09-14
Last modified:	2011-06-04
Identifier:	(3R,9Z)-17-[(2R,3S,4R,5R,6R)-5-amino-6-{[(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl]oxy}-3,4-dihydroxytetrahydro-2H-pyran-2-yl]-3-hydroxy-2,2-dimethyl-4,8,15-trioxo-12-thia-5,9,16-triazaheptadec-9-en-1-yl [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name)

BT1

BT1
Name:	{2-[4-(2-PYRROLIDIN-1-YL-ETHOXY)-PHENYL]-BENZO[B]THIOPHEN-3-YL}-[4-(2-PYRROLIDIN-1-YL-ETHOXY)-PHENYL]-METHANONE
Formula:	C32 H35 N3 O3 S
SMILES:	O=C(c1c4ccccc4sc1c3ccc(OCCN2CCCC2)cc3)c6ccc(OCCN5CCCC5)nc6
InChi:	InChI=1S/C32H35N3O3S/c36-31(25-11-14-29(33-23-25)38-22-20-35-17-5-6-18-35)30-27-7-1-2-8-28(27)39-32(30)24-9-12-26(13-10-24)37-21-19-34-15-3-4-16-34/h1-2,7-14,23H,3-6,15-22H2
Definition date:	1999-10-11
Last modified:	2011-06-04
Identifier:	{2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl}[6-(2-pyrrolidin-1-ylethoxy)pyridin-3-yl]methanone

BT2

BT2
Name:	3-[4-(2-PYRROLIDIN-1-YL-ETHOXY)-BENZYL]-2-4-(2-PYRROLIDIN-1-YL-ETHOXY)-PHENYL] -BENZO[B]THIOPHENE
Formula:	C33 H38 N2 O2 S
SMILES:	O(c1ccc(cc1)Cc2c5ccccc5sc2c4ccc(OCCN3CCCC3)cc4)CCN6CCCC6
InChi:	InChI=1S/C33H38N2O2S/c1-2-8-32-30(7-1)31(25-26-9-13-28(14-10-26)36-23-21-34-17-3-4-18-34)33(38-32)27-11-15-29(16-12-27)37-24-22-35-19-5-6-20-35/h1-2,7-16H,3-6,17-25H2
Definition date:	1999-10-11
Last modified:	2011-06-04
Identifier:	1-[2-(4-{3-[4-(2-pyrrolidin-1-ylethoxy)benzyl]-1-benzothiophen-2-yl}phenoxy)ethyl]pyrrolidine

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