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

Systemtic Name: ethyl 6-[(4-cyclohexylpiperazin-1-yl)methyl]-2-oxidanylidene-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(4-cyclohexylpiperazin-1-yl)methyl]-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(4-cyclohexyl-1-piperazinyl)methyl]-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-cyclohexylpiperazin-1-yl)methyl]-2-oxo-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(4-cyclohexylpiperazino)methyl]-2-keto-4-(3,4,5-trimethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C27H40N4O6 MolecularWeight: 516.6297

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C(=C2)OC)OC)OC)CN3CCN(CC3)C4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=C(C(=C2)OC)OC)OC)CN3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C27H40N4O6/c1-5-37-26(32)23-20(17-30-11-13-31(14-12-30)19-9-7-6-8-10-19)28-27(33)29-24(23)18-15-21(34-2)25(36-4)22(16-18)35-3/h15-16,19,24H,5-14,17H2,1-4H3,(H2,28,29,33)