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

Systemtic Name: methyl 3-(4-oxidanylidene-2-phenethylsulfanyl-quinazolin-3-yl)propanoate Openeye Name: methyl 3-(4-oxo-2-phenethylsulfanyl-quinazolin-3-yl)propanoate CAS Name: 3-[4-oxo-2-(phenethylthio)-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-(4-oxo-2-phenethylsulfanylquinazolin-3-yl)propanoate Traditional Name: 3-[4-keto-2-(phenethylthio)quinazolin-3-yl]propionic acid methyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCCC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S/c1-25-18(23)11-13-22-19(24)16-9-5-6-10-17(16)21-20(22)26-14-12-15-7-3-2-4-8-15/h2-10H,11-14H2,1H3