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

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-N-ethyl-1-methyl-2,4-bis(oxidanylidene)-N-phenyl-quinazoline-6-sulfonamide Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-N-ethyl-1-methyl-2,4-dioxo-N-phenyl-quinazoline-6-sulfonamide CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-N-ethyl-1-methyl-2,4-dioxo-N-phenyl-6-quinazolinesulfonamide IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-N-ethyl-1-methyl-2,4-dioxo-N-phenylquinazoline-6-sulfonamide Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-N-ethyl-2,4-diketo-1-methyl-N-phenyl-quinazoline-6-sulfonamide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CC(=O)N4CCCCCC4)C

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CC(=O)N4CCCCCC4)C

InChI

InChI=1S/C25H30N4O5S/c1-3-29(19-11-7-6-8-12-19)35(33,34)20-13-14-22-21(17-20)24(31)28(25(32)26(22)2)18-23(30)27-15-9-4-5-10-16-27/h6-8,11-14,17H,3-5,9-10,15-16,18H2,1-2H3