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

Systemtic Name: ethyl 6-(3-chlorophenyl)-3-methyl-4-[(4-methylpiperidin-1-yl)methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(3-chlorophenyl)-3-methyl-4-[(4-methyl-1-piperidyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3-chlorophenyl)-3-methyl-4-[(4-methyl-1-piperidinyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(3-chlorophenyl)-3-methyl-4-[(4-methylpiperidin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3-chlorophenyl)-2-keto-3-methyl-4-[(4-methylpiperidino)methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H28ClN3O3 MolecularWeight: 405.91832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)Cl)C)CN3CCC(CC3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)Cl)C)CN3CCC(CC3)C

InChI

InChI=1S/C21H28ClN3O3/c1-4-28-20(26)18-17(13-25-10-8-14(2)9-11-25)24(3)21(27)23-19(18)15-6-5-7-16(22)12-15/h5-7,12,14,19H,4,8-11,13H2,1-3H3,(H,23,27)