methyl 3-ethyl-4-oxidanylidene-2-(phenylmethylsulfanyl)quinazoline-7-carboxylate

Systemtic Name: methyl 3-ethyl-4-oxidanylidene-2-(phenylmethylsulfanyl)quinazoline-7-carboxylate Openeye Name: methyl 2-benzylsulfanyl-3-ethyl-4-oxo-quinazoline-7-carboxylate CAS Name: 3-ethyl-4-oxo-2-(phenylmethylthio)-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-benzylsulfanyl-3-ethyl-4-oxoquinazoline-7-carboxylate Traditional Name: 2-(benzylthio)-3-ethyl-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3S/c1-3-21-17(22)15-10-9-14(18(23)24-2)11-16(15)20-19(21)25-12-13-7-5-4-6-8-13/h4-11H,3,12H2,1-2H3