6,7-diethoxy-3-[4-oxidanylidene-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6,7-diethoxy-3-[4-oxidanylidene-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6,7-diethoxy-3-[4-oxo-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 6,7-diethoxy-3-[4-oxo-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6,7-diethoxy-3-[4-oxo-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6,7-diethoxy-3-[4-keto-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-2-thioxo-1H-quinazolin-4-one Formula: C27H31N3O4S MolecularWeight: 493.61774

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)N3CCC(=CC3)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCCC(=O)N3CCC(=CC3)C4=CC=CC=C4)OCC

InChI

InChI=1S/C27H31N3O4S/c1-3-33-23-17-21-22(18-24(23)34-4-2)28-27(35)30(26(21)32)14-8-11-25(31)29-15-12-20(13-16-29)19-9-6-5-7-10-19/h5-7,9-10,12,17-18H,3-4,8,11,13-16H2,1-2H3,(H,28,35)