tert-butyl 4-[4-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methylcarbamoyl]-2-phenyl-pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methylcarbamoyl]-2-phenyl-pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-phenyl-4-[[1-(p-tolylmethyl)-4-piperidyl]methylcarbamoyl]pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[[1-[(4-methylphenyl)methyl]-4-piperidinyl]methylamino]-oxomethyl]-2-phenyl-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[[1-[(4-methylphenyl)methyl]piperidin-4-yl]methylcarbamoyl]-2-phenylpyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[[1-(4-methylbenzyl)-4-piperidyl]methylcarbamoyl]-2-phenyl-pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C34H45N5O3 MolecularWeight: 571.7528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCC(CC2)CNC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C5CCN(CC5)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCC(CC2)CNC(=O)C3=C(N(N=C3)C4=CC=CC=C4)C5CCN(CC5)C(=O)OC(C)(C)C

InChI

InChI=1S/C34H45N5O3/c1-25-10-12-27(13-11-25)24-37-18-14-26(15-19-37)22-35-32(40)30-23-36-39(29-8-6-5-7-9-29)31(30)28-16-20-38(21-17-28)33(41)42-34(2,3)4/h5-13,23,26,28H,14-22,24H2,1-4H3,(H,35,40)