methyl 3-[(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 3-[(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 3-[(3-allyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 3-[[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 3-[[(3-allyl-4-keto-quinazolin-2-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CO1)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

COC(=O)C1=C(C=CO1)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C18H16N2O4S/c1-3-9-20-16(21)13-6-4-5-7-14(13)19-18(20)25-11-12-8-10-24-15(12)17(22)23-2/h3-8,10H,1,9,11H2,2H3