propan-2-yl 3-butyl-6-[3-(3-cyclopentylpropanoylamino)phenyl]-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CCC3CCCC3)C(=O)OC(C)C)C

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CCC3CCCC3)C(=O)OC(C)C)C

InChI

InChI=1S/C27H39N3O4/c1-5-6-16-30-19(4)24(26(32)34-18(2)3)25(29-27(30)33)21-12-9-13-22(17-21)28-23(31)15-14-20-10-7-8-11-20/h9,12-13,17-18,20,25H,5-8,10-11,14-16H2,1-4H3,(H,28,31)(H,29,33)