N-[2-(3-methylphenyl)ethyl]-2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide

Systemtic Name: N-[2-(3-methylphenyl)ethyl]-2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Openeye Name: N-[2-(m-tolyl)ethyl]-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide CAS Name: N-[2-(3-methylphenyl)ethyl]-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide IUPAC Name: N-[2-(3-methylphenyl)ethyl]-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Traditional Name: 2,4-diketo-N-[2-(m-tolyl)ethyl]-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC(=O)N3

Isomeric SMILES

CC1=CC(=CC=C1)CCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC(=O)N3

InChI

InChI=1S/C18H19N3O4S/c1-12-3-2-4-13(9-12)7-8-19-26(24,25)14-5-6-15-16(10-14)21-18(23)11-17(22)20-15/h2-6,9-10,19H,7-8,11H2,1H3,(H,20,22)(H,21,23)