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

Systemtic Name: ethyl 6-(4-chlorophenyl)-4-[(4-methylpiperidin-1-yl)methyl]-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-allyl-6-(4-chlorophenyl)-4-[(4-methyl-1-piperidyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-chlorophenyl)-4-[(4-methyl-1-piperidinyl)methyl]-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-chlorophenyl)-4-[(4-methylpiperidin-1-yl)methyl]-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-allyl-6-(4-chlorophenyl)-2-keto-4-[(4-methylpiperidino)methyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C23H30ClN3O3 MolecularWeight: 431.9556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30ClN3O3/c1-4-12-27-19(15-26-13-10-16(3)11-14-26)20(22(28)30-5-2)21(25-23(27)29)17-6-8-18(24)9-7-17/h4,6-9,16,21H,1,5,10-15H2,2-3H3,(H,25,29)