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

Systemtic Name: ethyl 4-[[3-[bis(2-methoxyethyl)sulfamoyl]phenyl]carbonylamino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 4-[[3-[bis(2-methoxyethyl)sulfamoyl]benzoyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 4-[[[3-[bis(2-methoxyethyl)sulfamoyl]phenyl]-oxomethyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-[bis(2-methoxyethyl)sulfamoyl]benzoyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 4-[[3-[bis(2-methoxyethyl)sulfamoyl]benzoyl]amino]-2-ethyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C27H34N4O7S MolecularWeight: 558.64646

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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(CCOC)CCOC)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C27H34N4O7S/c1-5-21-24(27(33)38-6-2)25(29-23-13-8-7-12-22(23)28-21)30-26(32)19-10-9-11-20(18-19)39(34,35)31(14-16-36-3)15-17-37-4/h7-13,18,28H,5-6,14-17H2,1-4H3,(H,29,30,32)