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

Systemtic Name: 1-(4-methylphenyl)-N-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-[3-(4-benzyl-1-piperidyl)propyl]-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(4-methylphenyl)-N-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-(4-benzylpiperidin-1-yl)propyl]-1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[3-(4-benzylpiperidino)propyl]-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C30H35N5O MolecularWeight: 481.6318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCCN3CCC(CC3)CC4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCCN3CCC(CC3)CC4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C30H35N5O/c1-24-10-12-27(13-11-24)35-30(34-18-5-6-19-34)28(23-32-35)29(36)31-16-7-17-33-20-14-26(15-21-33)22-25-8-3-2-4-9-25/h2-6,8-13,18-19,23,26H,7,14-17,20-22H2,1H3,(H,31,36)