methyl 3-butyl-2-methylsulfanyl-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 3-butyl-2-methylsulfanyl-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-butyl-2-methylsulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 3-butyl-2-(methylthio)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-butyl-2-methylsulfanyl-4-oxoquinazoline-7-carboxylate Traditional Name: 3-butyl-4-keto-2-(methylthio)quinazoline-7-carboxylic acid methyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SC

Isomeric SMILES

CCCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SC

InChI

InChI=1S/C15H18N2O3S/c1-4-5-8-17-13(18)11-7-6-10(14(19)20-2)9-12(11)16-15(17)21-3/h6-7,9H,4-5,8H2,1-3H3