ethyl 6-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]methyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxidanylidene-piperazin-1-yl]methyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-oxo-piperazin-1-yl]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-3-oxo-1-piperazinyl]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-oxopiperazin-1-yl]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-3-keto-piperazino]methyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C25H32N6O4 MolecularWeight: 480.55938

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)CN2CCNC(=O)C2C3=C(N(N=C3C)C4=CC=CC=C4)C)C(=O)OCC

Isomeric SMILES

CCC1C(=C(NC(=O)N1)CN2CCNC(=O)C2C3=C(N(N=C3C)C4=CC=CC=C4)C)C(=O)OCC

InChI

InChI=1S/C25H32N6O4/c1-5-18-21(24(33)35-6-2)19(28-25(34)27-18)14-30-13-12-26-23(32)22(30)20-15(3)29-31(16(20)4)17-10-8-7-9-11-17/h7-11,18,22H,5-6,12-14H2,1-4H3,(H,26,32)(H2,27,28,34)