ethyl 4-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylbutanoate

Systemtic Name: ethyl 4-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylbutanoate Openeye Name: ethyl 4-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylbutanoate CAS Name: 4-[(4-oxo-3-phenyl-2-quinazolinyl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-(4-oxo-3-phenylquinazolin-2-yl)sulfanylbutanoate Traditional Name: 4-[(4-keto-3-phenyl-quinazolin-2-yl)thio]butyric acid ethyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S/c1-2-25-18(23)13-8-14-26-20-21-17-12-7-6-11-16(17)19(24)22(20)15-9-4-3-5-10-15/h3-7,9-12H,2,8,13-14H2,1H3