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

Systemtic Name: methyl 2-(3-methylbut-2-enylsulfanyl)-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-isobutyl-2-(3-methylbut-2-enylsulfanyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 2-(3-methylbut-2-enylthio)-3-(2-methylpropyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(3-methylbut-2-enylsulfanyl)-3-(2-methylpropyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 3-isobutyl-4-keto-2-(3-methylbut-2-enylthio)quinazoline-7-carboxylic acid methyl ester Formula: C19H24N2O3S MolecularWeight: 360.47046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC=C(C)C

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC=C(C)C

InChI

InChI=1S/C19H24N2O3S/c1-12(2)8-9-25-19-20-16-10-14(18(23)24-5)6-7-15(16)17(22)21(19)11-13(3)4/h6-8,10,13H,9,11H2,1-5H3