methyl 2-[(2R)-1-methoxy-1-oxidanylidene-propan-2-yl]sulfanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(2R)-1-methoxy-1-oxidanylidene-propan-2-yl]sulfanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-isobutyl-2-[(1R)-2-methoxy-1-methyl-2-oxo-ethyl]sulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[[(2R)-1-methoxy-1-oxopropan-2-yl]thio]-3-(2-methylpropyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2R)-1-methoxy-1-oxopropan-2-yl]sulfanyl-3-(2-methylpropyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 3-isobutyl-4-keto-2-[[(1R)-2-keto-2-methoxy-1-methyl-ethyl]thio]quinazoline-7-carboxylic acid methyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SC(C)C(=O)OC

Isomeric SMILES

C[C@H](C(=O)OC)SC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CC(C)C

InChI

InChI=1S/C18H22N2O5S/c1-10(2)9-20-15(21)13-7-6-12(17(23)25-5)8-14(13)19-18(20)26-11(3)16(22)24-4/h6-8,10-11H,9H2,1-5H3/t11-/m1/s1