methyl 3-ethyl-4-oxidanylidene-2-propan-2-ylsulfanyl-quinazoline-7-carboxylate

Systemtic Name: methyl 3-ethyl-4-oxidanylidene-2-propan-2-ylsulfanyl-quinazoline-7-carboxylate Openeye Name: methyl 3-ethyl-2-isopropylsulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 3-ethyl-4-oxo-2-(propan-2-ylthio)-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-ethyl-4-oxo-2-propan-2-ylsulfanylquinazoline-7-carboxylate Traditional Name: 3-ethyl-2-(isopropylthio)-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SC(C)C

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SC(C)C

InChI

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