N-[(4-methylphenyl)methyl]-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: 1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-N-(p-tolylmethyl)piperidine-4-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-1-[[3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-1-(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(4-methylbenzyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)isonipecotamide Formula: C29H31N5O2 MolecularWeight: 481.58874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C(=O)C3=C(N(N=C3C)C4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2CCN(CC2)C(=O)C3=C(N(N=C3C)C4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C29H31N5O2/c1-21-10-12-23(13-11-21)20-30-27(35)24-14-18-33(19-15-24)29(36)26-22(2)31-34(25-8-4-3-5-9-25)28(26)32-16-6-7-17-32/h3-13,16-17,24H,14-15,18-20H2,1-2H3,(H,30,35)