2-methylpropyl (6R)-6-(4-aminophenyl)-3-butyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl (6R)-6-(4-aminophenyl)-3-butyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl (6R)-6-(4-aminophenyl)-3-butyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-6-(4-aminophenyl)-3-butyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (6R)-6-(4-aminophenyl)-3-butyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(4-aminophenyl)-3-butyl-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C20H29N3O3 MolecularWeight: 359.46256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)N)C(=O)OCC(C)C)C

Isomeric SMILES

CCCCN1C(=C([C@H](NC1=O)C2=CC=C(C=C2)N)C(=O)OCC(C)C)C

InChI

InChI=1S/C20H29N3O3/c1-5-6-11-23-14(4)17(19(24)26-12-13(2)3)18(22-20(23)25)15-7-9-16(21)10-8-15/h7-10,13,18H,5-6,11-12,21H2,1-4H3,(H,22,25)/t18-/m1/s1