ethyl 4-[[1-(2,4-dimethylphenyl)-5-piperidin-4-yl-pyrazol-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(2,4-dimethylphenyl)-5-piperidin-4-yl-pyrazol-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(2,4-dimethylphenyl)-5-(4-piperidyl)pyrazole-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[1-(2,4-dimethylphenyl)-5-(4-piperidinyl)-4-pyrazolyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(2,4-dimethylphenyl)-5-piperidin-4-ylpyrazole-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-(2,4-dimethylphenyl)-5-(4-piperidyl)pyrazole-4-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C25H35N5O3 MolecularWeight: 453.5771

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(N=C2)C3=C(C=C(C=C3)C)C)C4CCNCC4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N(N=C2)C3=C(C=C(C=C3)C)C)C4CCNCC4

InChI

InChI=1S/C25H35N5O3/c1-4-33-25(32)29-13-9-20(10-14-29)28-24(31)21-16-27-30(22-6-5-17(2)15-18(22)3)23(21)19-7-11-26-12-8-19/h5-6,15-16,19-20,26H,4,7-14H2,1-3H3,(H,28,31)