methyl 2-(4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanylethanoate Openeye Name: methyl 2-(4-oxo-3-phenethyl-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(4-oxo-3-phenethyl-2-quinazolinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(4-oxo-3-phenethylquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-keto-3-phenethyl-quinazolin-2-yl)thio]acetic acid methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CCC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3S/c1-24-17(22)13-25-19-20-16-10-6-5-9-15(16)18(23)21(19)12-11-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3