N-[4-(azepan-1-yl)phenyl]-2,4-bis(oxidanylidene)-1H-quinazoline-6-sulfonamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2,4-bis(oxidanylidene)-1H-quinazoline-6-sulfonamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2,4-dioxo-1H-quinazoline-6-sulfonamide CAS Name: N-[4-(1-azepanyl)phenyl]-2,4-dioxo-1H-quinazoline-6-sulfonamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2,4-dioxo-1H-quinazoline-6-sulfonamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2,4-diketo-1H-quinazoline-6-sulfonamide Formula: C20H22N4O4S MolecularWeight: 414.47808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)NC4=O

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)NC4=O

InChI

InChI=1S/C20H22N4O4S/c25-19-17-13-16(9-10-18(17)21-20(26)22-19)29(27,28)23-14-5-7-15(8-6-14)24-11-3-1-2-4-12-24/h5-10,13,23H,1-4,11-12H2,(H2,21,22,25,26)