N-(2-methylphenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methylphenyl)-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-(o-tolyl)piperidine-4-carboxamide CAS Name: N-(2-methylphenyl)-1-[[3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(2-methylphenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: 1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-N-(o-tolyl)isonipecotamide Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)C3=C(N(N=C3C)C4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)C3=C(N(N=C3C)C4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C28H29N5O2/c1-20-10-6-7-13-24(20)29-26(34)22-14-18-32(19-15-22)28(35)25-21(2)30-33(23-11-4-3-5-12-23)27(25)31-16-8-9-17-31/h3-13,16-17,22H,14-15,18-19H2,1-2H3,(H,29,34)