methyl 2-(2-methylsulfanylethylsulfanyl)-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate

Systemtic Name: methyl 2-(2-methylsulfanylethylsulfanyl)-4-oxidanylidene-3-phenyl-quinazoline-7-carboxylate Openeye Name: methyl 2-(2-methylsulfanylethylsulfanyl)-4-oxo-3-phenyl-quinazoline-7-carboxylate CAS Name: 2-[2-(methylthio)ethylthio]-4-oxo-3-phenyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-methylsulfanylethylsulfanyl)-4-oxo-3-phenylquinazoline-7-carboxylate Traditional Name: 4-keto-2-[2-(methylthio)ethylthio]-3-phenyl-quinazoline-7-carboxylic acid methyl ester Formula: C19H18N2O3S2 MolecularWeight: 386.48782

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCSC)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCCSC)C3=CC=CC=C3

InChI

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