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

Systemtic Name: (phenylmethyl) 2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoate Openeye Name: benzyl 2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(3-methyl-4-oxo-2-quinazolinyl)thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetic acid benzyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H16N2O3S/c1-20-17(22)14-9-5-6-10-15(14)19-18(20)24-12-16(21)23-11-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3