ethyl 4-[(4-cyclopentylcarbonyl-3-methyl-piperazin-1-yl)methyl]-6-(3,4-dimethoxyphenyl)-3-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(4-cyclopentylcarbonyl-3-methyl-piperazin-1-yl)methyl]-6-(3,4-dimethoxyphenyl)-3-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-[[4-(cyclopentanecarbonyl)-3-methyl-piperazin-1-yl]methyl]-6-(3,4-dimethoxyphenyl)-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-[[4-[cyclopentyl(oxo)methyl]-3-methyl-1-piperazinyl]methyl]-6-(3,4-dimethoxyphenyl)-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(cyclopentanecarbonyl)-3-methylpiperazin-1-yl]methyl]-6-(3,4-dimethoxyphenyl)-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-[[4-(cyclopentanecarbonyl)-3-methyl-piperazino]methyl]-6-(3,4-dimethoxyphenyl)-2-keto-3-methyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C28H40N4O6 MolecularWeight: 528.6404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=C(C=C2)OC)OC)C)CN3CCN(C(C3)C)C(=O)C4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=C(C=C2)OC)OC)C)CN3CCN(C(C3)C)C(=O)C4CCCC4

InChI

InChI=1S/C28H40N4O6/c1-6-38-27(34)24-21(17-31-13-14-32(18(2)16-31)26(33)19-9-7-8-10-19)30(3)28(35)29-25(24)20-11-12-22(36-4)23(15-20)37-5/h11-12,15,18-19,25H,6-10,13-14,16-17H2,1-5H3,(H,29,35)