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

Systemtic Name: methyl 3-butyl-6-[3-(3-cyclopentylpropanoylamino)phenyl]-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C25H35N3O4 MolecularWeight: 441.5631

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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

Isomeric SMILES

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

InChI

InChI=1S/C25H35N3O4/c1-4-5-15-28-17(2)22(24(30)32-3)23(27-25(28)31)19-11-8-12-20(16-19)26-21(29)14-13-18-9-6-7-10-18/h8,11-12,16,18,23H,4-7,9-10,13-15H2,1-3H3,(H,26,29)(H,27,31)