ethyl 3-methyl-6-(3-methylphenyl)-4-[(2-methylpiperidin-1-yl)methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-methyl-6-(3-methylphenyl)-4-[(2-methylpiperidin-1-yl)methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-methyl-4-[(2-methyl-1-piperidyl)methyl]-6-(m-tolyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-methyl-6-(3-methylphenyl)-4-[(2-methyl-1-piperidinyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-6-(3-methylphenyl)-4-[(2-methylpiperidin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-3-methyl-4-[(2-methylpiperidino)methyl]-6-(m-tolyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)C)C)CN3CCCCC3C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)C)C)CN3CCCCC3C

InChI

InChI=1S/C22H31N3O3/c1-5-28-21(26)19-18(14-25-12-7-6-10-16(25)3)24(4)22(27)23-20(19)17-11-8-9-15(2)13-17/h8-9,11,13,16,20H,5-7,10,12,14H2,1-4H3,(H,23,27)