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

Systemtic Name: 2-(2,5-dimethylphenyl)-5-(1-methylpyrrol-2-yl)-N-[1-(phenylmethyl)piperidin-4-yl]pyrazole-3-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-(2,5-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide CAS Name: 2-(2,5-dimethylphenyl)-5-(1-methyl-2-pyrrolyl)-N-[1-(phenylmethyl)-4-piperidinyl]-3-pyrazolecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-(2,5-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-(2,5-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carboxamide Formula: C29H33N5O MolecularWeight: 467.60522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H33N5O/c1-21-11-12-22(2)27(18-21)34-28(19-25(31-34)26-10-7-15-32(26)3)29(35)30-24-13-16-33(17-14-24)20-23-8-5-4-6-9-23/h4-12,15,18-19,24H,13-14,16-17,20H2,1-3H3,(H,30,35)