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

Systemtic Name: N-[2-(3-methylphenoxy)phenyl]-2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Openeye Name: N-[2-(3-methylphenoxy)phenyl]-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide CAS Name: N-[2-(3-methylphenoxy)phenyl]-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide IUPAC Name: N-[2-(3-methylphenoxy)phenyl]-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Traditional Name: 2,4-diketo-N-[2-(3-methylphenoxy)phenyl]-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Formula: C22H19N3O5S MolecularWeight: 437.46836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=CC=C2NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC(=O)N4

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=CC=C2NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC(=O)N4

InChI

InChI=1S/C22H19N3O5S/c1-14-5-4-6-15(11-14)30-20-8-3-2-7-18(20)25-31(28,29)16-9-10-17-19(12-16)24-22(27)13-21(26)23-17/h2-12,25H,13H2,1H3,(H,23,26)(H,24,27)