methyl 3-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)propanoate

Systemtic Name: methyl 3-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)propanoate Openeye Name: methyl 3-(4-oxo-2-phenacylsulfanyl-quinazolin-3-yl)propanoate CAS Name: 3-[4-oxo-2-(phenacylthio)-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-(4-oxo-2-phenacylsulfanylquinazolin-3-yl)propanoate Traditional Name: 3-[4-keto-2-(phenacylthio)quinazolin-3-yl]propionic acid methyl ester Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H18N2O4S/c1-26-18(24)11-12-22-19(25)15-9-5-6-10-16(15)21-20(22)27-13-17(23)14-7-3-2-4-8-14/h2-10H,11-13H2,1H3