ethyl 4-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]butanoate

Systemtic Name: ethyl 4-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]butanoate Openeye Name: ethyl 4-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]butanoate CAS Name: 4-[(4-oxo-1H-quinazolin-2-yl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]butanoate Traditional Name: 4-[(4-keto-1H-quinazolin-2-yl)thio]butyric acid ethyl ester Formula: C14H16N2O3S MolecularWeight: 292.35344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC(=O)C2=CC=CC=C2N1

Isomeric SMILES

CCOC(=O)CCCSC1=NC(=O)C2=CC=CC=C2N1

InChI

InChI=1S/C14H16N2O3S/c1-2-19-12(17)8-5-9-20-14-15-11-7-4-3-6-10(11)13(18)16-14/h3-4,6-7H,2,5,8-9H2,1H3,(H,15,16,18)