ethyl 3-methyl-6-(4-methylphenyl)-2-oxidanylidene-4-(piperazin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-methyl-6-(4-methylphenyl)-2-oxidanylidene-4-(piperazin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-methyl-2-oxo-4-(piperazin-1-ylmethyl)-6-(p-tolyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-methyl-6-(4-methylphenyl)-2-oxo-4-(1-piperazinylmethyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-6-(4-methylphenyl)-2-oxo-4-(piperazin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-3-methyl-4-(piperazinomethyl)-6-(p-tolyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C20H28N4O3 MolecularWeight: 372.46132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)C)C)CN3CCNCC3

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)C)C)CN3CCNCC3

InChI

InChI=1S/C20H28N4O3/c1-4-27-19(25)17-16(13-24-11-9-21-10-12-24)23(3)20(26)22-18(17)15-7-5-14(2)6-8-15/h5-8,18,21H,4,9-13H2,1-3H3,(H,22,26)