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

Systemtic Name: methyl 3-butyl-6-[4-(dodecanoylamino)phenyl]-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 3-butyl-6-[4-(dodecanoylamino)phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-4-methyl-2-oxo-6-[4-(1-oxododecylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-butyl-6-[4-(dodecanoylamino)phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-2-keto-6-[4-(lauroylamino)phenyl]-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C29H45N3O4 MolecularWeight: 499.6853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)C2C(=C(N(C(=O)N2)CCCC)C)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=CC=C(C=C1)C2C(=C(N(C(=O)N2)CCCC)C)C(=O)OC

InChI

InChI=1S/C29H45N3O4/c1-5-7-9-10-11-12-13-14-15-16-25(33)30-24-19-17-23(18-20-24)27-26(28(34)36-4)22(3)32(21-8-6-2)29(35)31-27/h17-20,27H,5-16,21H2,1-4H3,(H,30,33)(H,31,35)