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

Systemtic Name: ethyl 4-(2-methylphenyl)-6-[(2-methylpiperidin-1-yl)methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(2-methyl-1-piperidyl)methyl]-4-(o-tolyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(2-methylphenyl)-6-[(2-methyl-1-piperidinyl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methylphenyl)-6-[(2-methylpiperidin-1-yl)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[(2-methylpiperidino)methyl]-4-(o-tolyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2C)CN3CCCCC3C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2C)CN3CCCCC3C

InChI

InChI=1S/C21H29N3O3/c1-4-27-20(25)18-17(13-24-12-8-7-10-15(24)3)22-21(26)23-19(18)16-11-6-5-9-14(16)2/h5-6,9,11,15,19H,4,7-8,10,12-13H2,1-3H3,(H2,22,23,26)