ethyl 6-(4-tert-butylphenyl)-4-[(4-cyclopentylcarbonylpiperazin-1-yl)methyl]-3-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(4-tert-butylphenyl)-4-[(4-cyclopentylcarbonylpiperazin-1-yl)methyl]-3-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(4-tert-butylphenyl)-4-[[4-(cyclopentanecarbonyl)piperazin-1-yl]methyl]-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-tert-butylphenyl)-4-[[4-[cyclopentyl(oxo)methyl]-1-piperazinyl]methyl]-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-tert-butylphenyl)-4-[[4-(cyclopentanecarbonyl)piperazin-1-yl]methyl]-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-tert-butylphenyl)-4-[[4-(cyclopentanecarbonyl)piperazino]methyl]-2-keto-3-methyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C29H42N4O4 MolecularWeight: 510.66818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)C(C)(C)C)C)CN3CCN(CC3)C(=O)C4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=C(C=C2)C(C)(C)C)C)CN3CCN(CC3)C(=O)C4CCCC4

InChI

InChI=1S/C29H42N4O4/c1-6-37-27(35)24-23(19-32-15-17-33(18-16-32)26(34)21-9-7-8-10-21)31(5)28(36)30-25(24)20-11-13-22(14-12-20)29(2,3)4/h11-14,21,25H,6-10,15-19H2,1-5H3,(H,30,36)