methyl (2R)-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate

Systemtic Name: methyl (2R)-2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate Openeye Name: methyl (2R)-2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanylpropanoate CAS Name: (2R)-2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate Traditional Name: (2R)-2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]propionic acid methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)OC

InChI

InChI=1S/C19H18N2O3S/c1-12-8-10-14(11-9-12)21-17(22)15-6-4-5-7-16(15)20-19(21)25-13(2)18(23)24-3/h4-11,13H,1-3H3/t13-/m1/s1