N-(2,6-diethylphenyl)-2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide

Systemtic Name: N-(2,6-diethylphenyl)-2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Openeye Name: N-(2,6-diethylphenyl)-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide CAS Name: N-(2,6-diethylphenyl)-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide IUPAC Name: N-(2,6-diethylphenyl)-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Traditional Name: N-(2,6-diethylphenyl)-2,4-diketo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Formula: C19H21N3O4S MolecularWeight: 387.45274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC(=O)N3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CC(=O)N3

InChI

InChI=1S/C19H21N3O4S/c1-3-12-6-5-7-13(4-2)19(12)22-27(25,26)14-8-9-15-16(10-14)21-18(24)11-17(23)20-15/h5-10,22H,3-4,11H2,1-2H3,(H,20,23)(H,21,24)