methyl 2-[2-[(4-methylsulfanylphenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[(4-methylsulfanylphenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[(4-methylsulfanylphenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[[4-(methylthio)phenyl]methylthio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(4-methylsulfanylphenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[4-keto-2-[[4-(methylthio)benzyl]thio]quinazolin-3-yl]acetic acid methyl ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)SC

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)SC

InChI

InChI=1S/C19H18N2O3S2/c1-24-17(22)11-21-18(23)15-5-3-4-6-16(15)20-19(21)26-12-13-7-9-14(25-2)10-8-13/h3-10H,11-12H2,1-2H3