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

Systemtic Name: ethyl 6-(4-tert-butylphenyl)-3-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(4-tert-butylphenyl)-3-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(4-tert-butylphenyl)-3-ethyl-4-[(4-ethyl-1-piperazinyl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(4-tert-butylphenyl)-3-ethyl-4-[(4-ethylpiperazin-1-yl)methyl]-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(4-tert-butylphenyl)-3-ethyl-4-[(4-ethylpiperazino)methyl]-2-keto-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C26H40N4O3 MolecularWeight: 456.6208

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(C(NC(=O)N2CC)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC

Isomeric SMILES

CCN1CCN(CC1)CC2=C(C(NC(=O)N2CC)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC

InChI

InChI=1S/C26H40N4O3/c1-7-28-14-16-29(17-15-28)18-21-22(24(31)33-9-3)23(27-25(32)30(21)8-2)19-10-12-20(13-11-19)26(4,5)6/h10-13,23H,7-9,14-18H2,1-6H3,(H,27,32)