ethyl 4-[[3-[(3-chlorophenyl)-methyl-sulfamoyl]phenyl]carbonylamino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 4-[[3-[(3-chlorophenyl)-methyl-sulfamoyl]phenyl]carbonylamino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 4-[[3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 4-[[[3-[(3-chlorophenyl)-methylsulfamoyl]phenyl]-oxomethyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-[(3-chlorophenyl)-methylsulfamoyl]benzoyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 4-[[3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C28H27ClN4O5S MolecularWeight: 567.05578

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N(C)C4=CC(=CC=C4)Cl)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N(C)C4=CC(=CC=C4)Cl)C(=O)OCC

InChI

InChI=1S/C28H27ClN4O5S/c1-4-22-25(28(35)38-5-2)26(31-24-15-7-6-14-23(24)30-22)32-27(34)18-10-8-13-21(16-18)39(36,37)33(3)20-12-9-11-19(29)17-20/h6-17,30H,4-5H2,1-3H3,(H,31,32,34)