3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1-methyl-N-(2-methylphenyl)-2,4-bis(oxidanylidene)quinazoline-6-sulfonamide

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-1-methyl-N-(2-methylphenyl)-2,4-bis(oxidanylidene)quinazoline-6-sulfonamide Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-1-methyl-N-(o-tolyl)-2,4-dioxo-quinazoline-6-sulfonamide CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-1-methyl-N-(2-methylphenyl)-2,4-dioxo-6-quinazolinesulfonamide IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-1-methyl-N-(2-methylphenyl)-2,4-dioxoquinazoline-6-sulfonamide Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-2,4-diketo-1-methyl-N-(o-tolyl)quinazoline-6-sulfonamide Formula: C24H28N4O5S MolecularWeight: 484.56792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CC(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CC(=O)N4CCCCCC4)C

InChI

InChI=1S/C24H28N4O5S/c1-17-9-5-6-10-20(17)25-34(32,33)18-11-12-21-19(15-18)23(30)28(24(31)26(21)2)16-22(29)27-13-7-3-4-8-14-27/h5-6,9-12,15,25H,3-4,7-8,13-14,16H2,1-2H3