methyl 2-[4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]propanoate

Systemtic Name: methyl 2-[4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]propanoate Openeye Name: methyl 2-[4-(4-oxo-2-thioxo-1H-quinazolin-3-yl)phenyl]propanoate CAS Name: 2-[4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-[4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)phenyl]propanoate Traditional Name: 2-[4-(4-keto-2-thioxo-1H-quinazolin-3-yl)phenyl]propionic acid methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S)C(=O)OC

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3NC2=S)C(=O)OC

InChI

InChI=1S/C18H16N2O3S/c1-11(17(22)23-2)12-7-9-13(10-8-12)20-16(21)14-5-3-4-6-15(14)19-18(20)24/h3-11H,1-2H3,(H,19,24)