2-methylpropyl 6-[3-(3-cyclopentylpropanoylamino)phenyl]-4-methyl-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl 6-[3-(3-cyclopentylpropanoylamino)phenyl]-4-methyl-2-oxidanylidene-3-propyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 6-[3-(3-cyclopentylpropanoylamino)phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[(3-cyclopentyl-1-oxopropyl)amino]phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 6-[3-(3-cyclopentylpropanoylamino)phenyl]-4-methyl-2-oxo-3-propyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-(3-cyclopentylpropanoylamino)phenyl]-2-keto-4-methyl-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C27H39N3O4 MolecularWeight: 469.61626

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CCC3CCCC3)C(=O)OCC(C)C)C

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CCC3CCCC3)C(=O)OCC(C)C)C

InChI

InChI=1S/C27H39N3O4/c1-5-15-30-19(4)24(26(32)34-17-18(2)3)25(29-27(30)33)21-11-8-12-22(16-21)28-23(31)14-13-20-9-6-7-10-20/h8,11-12,16,18,20,25H,5-7,9-10,13-15,17H2,1-4H3,(H,28,31)(H,29,33)