methyl 2-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-isobutyl-2-(2-methoxy-2-oxo-ethyl)sulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[(2-methoxy-2-oxoethyl)thio]-3-(2-methylpropyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-methoxy-2-oxoethyl)sulfanyl-3-(2-methylpropyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 3-isobutyl-4-keto-2-[(2-keto-2-methoxy-ethyl)thio]quinazoline-7-carboxylic acid methyl ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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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(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O5S/c1-10(2)8-19-15(21)12-6-5-11(16(22)24-4)7-13(12)18-17(19)25-9-14(20)23-3/h5-7,10H,8-9H2,1-4H3