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

Systemtic Name: 1-(4-methylphenyl)-N-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[2-(4-benzyl-1-piperidyl)ethyl]-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(4-methylphenyl)-N-[2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-(4-benzylpiperidin-1-yl)ethyl]-1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[2-(4-benzylpiperidino)ethyl]-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C29H33N5O MolecularWeight: 467.60522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCN3CCC(CC3)CC4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCN3CCC(CC3)CC4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C29H33N5O/c1-23-9-11-26(12-10-23)34-29(33-16-5-6-17-33)27(22-31-34)28(35)30-15-20-32-18-13-25(14-19-32)21-24-7-3-2-4-8-24/h2-12,16-17,22,25H,13-15,18-21H2,1H3,(H,30,35)