methyl 3-[4-oxidanylidene-2-(phenylmethylsulfanyl)quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[4-oxidanylidene-2-(phenylmethylsulfanyl)quinazolin-3-yl]propanoate Openeye Name: methyl 3-(2-benzylsulfanyl-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-[4-oxo-2-(phenylmethylthio)-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-(2-benzylsulfanyl-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-[2-(benzylthio)-4-keto-quinazolin-3-yl]propionic acid methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=CC=C3

InChI

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