N-[(4-chlorophenyl)methyl]-4-(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)butanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)butanamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-(6,7-diethoxy-4-oxo-2-thioxo-1H-quinazolin-3-yl)butanamide CAS Name: N-[(4-chlorophenyl)methyl]-4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)butanamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)butanamide Traditional Name: N-(4-chlorobenzyl)-4-(6,7-diethoxy-4-keto-2-thioxo-1H-quinazolin-3-yl)butyramide Formula: C23H26ClN3O4S MolecularWeight: 475.98824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCCC(=O)NCC3=CC=C(C=C3)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCCC(=O)NCC3=CC=C(C=C3)Cl)OCC

InChI

InChI=1S/C23H26ClN3O4S/c1-3-30-19-12-17-18(13-20(19)31-4-2)26-23(32)27(22(17)29)11-5-6-21(28)25-14-15-7-9-16(24)10-8-15/h7-10,12-13H,3-6,11,14H2,1-2H3,(H,25,28)(H,26,32)