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

Systemtic Name: methyl 3-(2-methylpropyl)-2-(2-methylsulfanylethylsulfanyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-isobutyl-2-(2-methylsulfanylethylsulfanyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 3-(2-methylpropyl)-2-[2-(methylthio)ethylthio]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-(2-methylpropyl)-2-(2-methylsulfanylethylsulfanyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 3-isobutyl-4-keto-2-[2-(methylthio)ethylthio]quinazoline-7-carboxylic acid methyl ester Formula: C17H22N2O3S2 MolecularWeight: 366.49818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCCSC

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCCSC

InChI

InChI=1S/C17H22N2O3S2/c1-11(2)10-19-15(20)13-6-5-12(16(21)22-3)9-14(13)18-17(19)24-8-7-23-4/h5-6,9,11H,7-8,10H2,1-4H3