propan-2-yl (6R)-3-ethyl-4-methyl-6-[3-(2-methylpropanoylamino)phenyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl (6R)-3-ethyl-4-methyl-6-[3-(2-methylpropanoylamino)phenyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl (6R)-3-ethyl-4-methyl-6-[3-(2-methylpropanoylamino)phenyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-3-ethyl-4-methyl-6-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (6R)-3-ethyl-4-methyl-6-[3-(2-methylpropanoylamino)phenyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-3-ethyl-6-[3-(isobutyrylamino)phenyl]-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C(C)C)C(=O)OC(C)C)C

Isomeric SMILES

CCN1C(=C([C@H](NC1=O)C2=CC(=CC=C2)NC(=O)C(C)C)C(=O)OC(C)C)C

InChI

InChI=1S/C21H29N3O4/c1-7-24-14(6)17(20(26)28-13(4)5)18(23-21(24)27)15-9-8-10-16(11-15)22-19(25)12(2)3/h8-13,18H,7H2,1-6H3,(H,22,25)(H,23,27)/t18-/m1/s1