CAS RN: 826-65-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C10H8O2
MOLECULAR WEIGHT: 160.16932
SMILES: C1=CC2C3C(C1C2=O)C=CC3=O
Structure:
CAS RN: 88512-20-3
CAS Name: 3-(2-aminoethylthio)propanoic acid
OPENEYE Name: 3-(2-aminoethylsulfanyl)propanoic acid
IUPAC Name: 3-(2-aminoethylsulfanyl)propanoic acid
SYSTEMATIC NAME: 3-(2-azanylethylsulfanyl)propanoic acid
MOLECULAR FORMULA: C5H11NO2S
MOLECULAR WEIGHT: 149.21134
SMILES: C(CSCCN)C(=O)O
Structure:
CAS RN: 25288-35-1
CAS Name: 4-chloro-3-[[[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]phenyl]methylamino]-oxomethyl]amino]benzenesulfonyl fluoride; ethanesulfonic acid
OPENEYE Name: 4-chloro-3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoylamino]benzenesulfonyl fluoride; ethanesulfonic acid
IUPAC Name: 4-chloro-3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylcarbamoylamino]benzenesulfonyl fluoride; ethanesulfonic acid
SYSTEMATIC NAME: 3-[[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-3-chloranyl-phenyl]methylcarbamoylamino]-4-chloranyl-benzenesulfonyl fluoride; ethanesulfonic acid
MOLECULAR FORMULA: C27H25Cl4FN6O7S2
MOLECULAR WEIGHT: 770.463803
SMILES: CCS(=O)(=O)O.C1=CC(=C(C=C1CNC(=O)NC2=C(C=CC(=C2)S(=O)(=O)F)Cl)Cl)OCC3=C(C(=NC(=N3)N)N)C4=CC(=C(C=C4)Cl)Cl
Structure:
CAS RN: 25288-19-1
CAS Name: 4-[[[3-[2-[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]ethyl]phenyl]methylamino]-oxomethyl]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 4-[[3-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoyl]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 4-[[3-[2-[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoyl]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 4-[[3-[2-[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]ethyl]phenyl]methylcarbamoyl]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C26H24Cl2FN5O7S2
MOLECULAR WEIGHT: 672.532463
SMILES: C1=CC(=CC(=C1)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)F)CCC3=C(C(=NC(=N3)N)N)C4=CC(=C(C=C4)Cl)Cl.OS(=O)(=O)O
Structure:
CAS RN: 25349-36-4
CAS Name: 3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 3-[[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-3-chloranyl-phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C24H21Cl3FN5O9S3
MOLECULAR WEIGHT: 745.004043
SMILES: C1=CC(=CC(=C1)S(=O)(=O)F)S(=O)(=O)NCC2=CC(=C(C=C2)OCC3=C(C(=NC(=N3)N)N)C4=CC(=C(C=C4)Cl)Cl)Cl.OS(=O)(=O)O
Structure:
CAS RN: 32353-63-2
CAS Name: 3-(2,5-dimethyl-1,3-benzoxazol-3-ium-3-yl)propanoic acid
OPENEYE Name: 3-(2,5-dimethyl-1,3-benzoxazol-3-ium-3-yl)propanoic acid
IUPAC Name: 3-(2,5-dimethyl-1,3-benzoxazol-3-ium-3-yl)propanoic acid
SYSTEMATIC NAME: 3-(2,5-dimethyl-1,3-benzoxazol-3-ium-3-yl)propanoic acid
MOLECULAR FORMULA: C12H14NO3+
MOLECULAR WEIGHT: 220.24446
SMILES: CC1=CC2=C(C=C1)OC(=[N+]2CCC(=O)O)C
Structure:
CAS RN: 53316-00-0
CAS Name: 3,3-bis(phenylmethyl)pentane-2,4-dione
OPENEYE Name: 3,3-dibenzylpentane-2,4-dione
IUPAC Name: 3,3-dibenzylpentane-2,4-dione
SYSTEMATIC NAME: 3,3-bis(phenylmethyl)pentane-2,4-dione
MOLECULAR FORMULA: C19H20O2
MOLECULAR WEIGHT: 280.3609
SMILES: CC(=O)C(CC1=CC=CC=C1)(CC2=CC=CC=C2)C(=O)C
Structure:
CAS RN: 28642-79-7
CAS Name: 2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazine-6,8-diamine
OPENEYE Name: 2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazine-6,8-diamine
IUPAC Name: 2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazine-6,8-diamine
SYSTEMATIC NAME: 2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazine-6,8-diamine
MOLECULAR FORMULA: C25H29N5O6
MOLECULAR WEIGHT: 495.52766
SMILES: COC1=CC(=CC(=C1OC)OC)C2C(=NC3=NC(C=C(C3=N2)N)N)C4=CC(=C(C(=C4)OC)OC)OC
Structure:
CAS RN: 28642-72-0
CAS Name: N8-(diphenylmethyl)-2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazine-6,8-diamine
OPENEYE Name: N8-benzhydryl-2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazine-6,8-diamine
IUPAC Name: 8-N-benzhydryl-2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazine-6,8-diamine
SYSTEMATIC NAME: N8-(diphenylmethyl)-2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazine-6,8-diamine
MOLECULAR FORMULA: C38H39N5O6
MOLECULAR WEIGHT: 661.74616
SMILES: COC1=CC(=CC(=C1OC)OC)C2C(=NC3=NC(C=C(C3=N2)NC(C4=CC=CC=C4)C5=CC=CC=C5)N)C6=CC(=C(C(=C6)OC)OC)OC
Structure:
CAS RN: 28649-02-7
CAS Name: 8-chloro-2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazin-6-amine
OPENEYE Name: 8-chloro-2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazin-6-amine
IUPAC Name: 8-chloro-2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazin-6-amine
SYSTEMATIC NAME: 8-chloranyl-2,3-bis(3,4,5-trimethoxyphenyl)-2,6-dihydropyrido[2,3-b]pyrazin-6-amine
MOLECULAR FORMULA: C25H27ClN4O6
MOLECULAR WEIGHT: 514.95808
SMILES: COC1=CC(=CC(=C1OC)OC)C2C(=NC3=NC(C=C(C3=N2)Cl)N)C4=CC(=C(C(=C4)OC)OC)OC
Structure:
CAS RN: 41863-57-4
CAS Name: 3-hydroxy-2-[[2-[[[1-[2-[[3-hydroxy-2-[[3-hydroxy-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]-1-oxopropyl]amino]-1-oxoethyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-oxopropyl]amino]butanoic acid methyl ester
OPENEYE Name: methyl 2-[2-[[1-[2-[[2-[[2-(benzyloxycarbonylamino)-3-hydroxy-butanoyl]amino]-3-hydroxy-propanoyl]amino]acetyl]pyrrolidine-2-carbonyl]amino]propanoylamino]-3-hydroxy-butanoate
IUPAC Name: methyl 3-hydroxy-2-[2-[[1-[2-[[3-hydroxy-2-[[3-hydroxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoyl]amino]acetyl]pyrrolidine-2-carbonyl]amino]propanoylamino]butanoate
SYSTEMATIC NAME: methyl 3-oxidanyl-2-[2-[[1-[2-[[3-oxidanyl-2-[[3-oxidanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoyl]amino]ethanoyl]pyrrolidin-2-yl]carbonylamino]propanoylamino]butanoate
MOLECULAR FORMULA: C30H44N6O12
MOLECULAR WEIGHT: 680.70336
SMILES: CC(C(C(=O)NC(CO)C(=O)NCC(=O)N1CCCC1C(=O)NC(C)C(=O)NC(C(C)O)C(=O)OC)NC(=O)OCC2=CC=CC=C2)O
Structure:
CAS RN: 25288-29-3
CAS Name: 3-[[[2-[4-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]phenyl]ethylamino]-oxomethyl]amino]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 3-[2-[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]ethylcarbamoylamino]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 3-[2-[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]ethylcarbamoylamino]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 3-[2-[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]ethylcarbamoylamino]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C26H25Cl2FN6O8S2
MOLECULAR WEIGHT: 703.546503
SMILES: C1=CC(=CC(=C1)S(=O)(=O)F)NC(=O)NCCC2=CC=C(C=C2)OCC3=C(C(=NC(=N3)N)N)C4=CC(=C(C=C4)Cl)Cl.OS(=O)(=O)O
Structure:
CAS RN: 25288-17-9
CAS Name: 3-[[3-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 3-[[3-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 3-[[3-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 3-[[3-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C24H22Cl2FN5O9S3
MOLECULAR WEIGHT: 710.558983
SMILES: C1=CC(=CC(=C1)OCC2=C(C(=NC(=N2)N)N)C3=CC(=C(C=C3)Cl)Cl)CNS(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)F.OS(=O)(=O)O
Structure:
CAS RN: 25288-32-8
CAS Name: 4-[2-[4-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]phenyl]ethylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 4-[2-[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]ethylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 4-[2-[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]ethylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 4-[2-[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]ethylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C25H24Cl2FN5O9S3
MOLECULAR WEIGHT: 724.585563
SMILES: C1=CC(=CC=C1CCNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)F)OCC3=C(C(=NC(=N3)N)N)C4=CC(=C(C=C4)Cl)Cl.OS(=O)(=O)O
Structure:
CAS RN: 25313-35-3
CAS Name: 3-[[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]-3-methoxyphenyl]methylamino]-oxomethyl]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-3-methoxy-phenyl]methylcarbamoyl]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 3-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-3-methoxyphenyl]methylcarbamoyl]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 3-[[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-3-methoxy-phenyl]methylcarbamoyl]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C26H24Cl2FN5O9S2
MOLECULAR WEIGHT: 704.531263
SMILES: COC1=C(C=CC(=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)F)OCC3=C(C(=NC(=N3)N)N)C4=CC(=C(C=C4)Cl)Cl.OS(=O)(=O)O
Structure:
CAS RN: 25288-27-1
CAS Name: 4-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]-2-methylphenyl]sulfamoyl]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 4-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-2-methyl-phenyl]sulfamoyl]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 4-[[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-2-methylphenyl]sulfamoyl]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 4-[[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-2-methyl-phenyl]sulfamoyl]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C24H22Cl2FN5O9S3
MOLECULAR WEIGHT: 710.558983
SMILES: CC1=C(C=CC(=C1)OCC2=C(C(=NC(=N2)N)N)C3=CC(=C(C=C3)Cl)Cl)NS(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)F.OS(=O)(=O)O
Structure:
CAS RN: 25288-18-0
CAS Name: 4-[[3-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 4-[[3-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 4-[[3-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 4-[[3-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C24H22Cl2FN5O9S3
MOLECULAR WEIGHT: 710.558983
SMILES: C1=CC(=CC(=C1)OCC2=C(C(=NC(=N2)N)N)C3=CC(=C(C=C3)Cl)Cl)CNS(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)F.OS(=O)(=O)O
Structure:
CAS RN: 25288-30-6
CAS Name: 4-[[[2-[4-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]phenyl]ethylamino]-oxomethyl]amino]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 4-[2-[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]ethylcarbamoylamino]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 4-[2-[4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]ethylcarbamoylamino]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 4-[2-[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]ethylcarbamoylamino]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C26H25Cl2FN6O8S2
MOLECULAR WEIGHT: 703.546503
SMILES: C1=CC(=CC=C1CCNC(=O)NC2=CC=C(C=C2)S(=O)(=O)F)OCC3=C(C(=NC(=N3)N)N)C4=CC(=C(C=C4)Cl)Cl.OS(=O)(=O)O
Structure:
CAS RN: 25288-44-2
CAS Name: 4-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 4-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 4-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 4-[[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-3-chloranyl-phenyl]methylsulfamoyl]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C24H21Cl3FN5O9S3
MOLECULAR WEIGHT: 745.004043
SMILES: C1=CC(=CC=C1S(=O)(=O)NCC2=CC(=C(C=C2)OCC3=C(C(=NC(=N3)N)N)C4=CC(=C(C=C4)Cl)Cl)Cl)S(=O)(=O)F.OS(=O)(=O)O
Structure:
CAS RN: 25288-25-9
CAS Name: 3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)-4-pyrimidinyl]methoxy]phenyl]sulfamoyl]benzenesulfonyl fluoride; sulfuric acid
OPENEYE Name: 3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]sulfamoyl]benzenesulfonyl fluoride; sulfuric acid
IUPAC Name: 3-[[3-chloro-4-[[2,6-diamino-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]phenyl]sulfamoyl]benzenesulfonyl fluoride; sulfuric acid
SYSTEMATIC NAME: 3-[[4-[[2,6-bis(azanyl)-5-(3,4-dichlorophenyl)pyrimidin-4-yl]methoxy]-3-chloranyl-phenyl]sulfamoyl]benzenesulfonyl fluoride; sulfuric acid
MOLECULAR FORMULA: C23H19Cl3FN5O9S3
MOLECULAR WEIGHT: 730.977463
SMILES: C1=CC(=CC(=C1)S(=O)(=O)F)S(=O)(=O)NC2=CC(=C(C=C2)OCC3=C(C(=NC(=N3)N)N)C4=CC(=C(C=C4)Cl)Cl)Cl.OS(=O)(=O)O
Structure:
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