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

Systemtic Name: methyl 2-[(2R)-1-[(3-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-isobutyl-2-[(1R)-2-(3-methoxyanilino)-1-methyl-2-oxo-ethyl]sulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[[(2R)-1-(3-methoxyanilino)-1-oxopropan-2-yl]thio]-3-(2-methylpropyl)-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2R)-1-(3-methoxyanilino)-1-oxopropan-2-yl]sulfanyl-3-(2-methylpropyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 3-isobutyl-4-keto-2-[[(1R)-2-keto-2-(m-anisidino)-1-methyl-ethyl]thio]quinazoline-7-carboxylic acid methyl ester Formula: C24H27N3O5S MolecularWeight: 469.55328

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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)NC3=CC(=CC=C3)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=CC=C1)OC)SC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC(C)C

InChI

InChI=1S/C24H27N3O5S/c1-14(2)13-27-22(29)19-10-9-16(23(30)32-5)11-20(19)26-24(27)33-15(3)21(28)25-17-7-6-8-18(12-17)31-4/h6-12,14-15H,13H2,1-5H3,(H,25,28)/t15-/m1/s1