N,N-diethyl-3-[(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)carbonyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-[(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)carbonyl]benzenesulfonamide Openeye Name: N,N-diethyl-3-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepine-5-carbonyl)benzenesulfonamide CAS Name: N,N-diethyl-3-[(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-oxomethyl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepine-5-carbonyl)benzenesulfonamide Traditional Name: N,N-diethyl-3-(2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepine-5-carbonyl)benzenesulfonamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N2C(CC(=O)NC3=CC=CC=C32)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)N2C(CC(=O)NC3=CC=CC=C32)C

InChI

InChI=1S/C21H25N3O4S/c1-4-23(5-2)29(27,28)17-10-8-9-16(14-17)21(26)24-15(3)13-20(25)22-18-11-6-7-12-19(18)24/h6-12,14-15H,4-5,13H2,1-3H3,(H,22,25)