2-(4-methylphenyl)-5-(1-methylpyrrol-2-yl)-N-[1-(phenylmethyl)piperidin-4-yl]pyrazole-3-carboxamide

Systemtic Name: 2-(4-methylphenyl)-5-(1-methylpyrrol-2-yl)-N-[1-(phenylmethyl)piperidin-4-yl]pyrazole-3-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-5-(1-methylpyrrol-2-yl)-2-(p-tolyl)pyrazole-3-carboxamide CAS Name: 2-(4-methylphenyl)-5-(1-methyl-2-pyrrolyl)-N-[1-(phenylmethyl)-4-piperidinyl]-3-pyrazolecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-(4-methylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-5-(1-methylpyrrol-2-yl)-2-(p-tolyl)pyrazole-3-carboxamide Formula: C28H31N5O MolecularWeight: 453.57864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CN3C)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CN3C)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H31N5O/c1-21-10-12-24(13-11-21)33-27(19-25(30-33)26-9-6-16-31(26)2)28(34)29-23-14-17-32(18-15-23)20-22-7-4-3-5-8-22/h3-13,16,19,23H,14-15,17-18,20H2,1-2H3,(H,29,34)