1-(4-fluorophenyl)-3-methyl-N-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-3-methyl-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-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(4-fluorophenyl)-3-methyl-N-[2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-(4-benzylpiperidin-1-yl)ethyl]-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-[2-(4-benzylpiperidino)ethyl]-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C29H32FN5O MolecularWeight: 485.595683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCN2CCC(CC2)CC3=CC=CC=C3)N4C=CC=C4)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCN2CCC(CC2)CC3=CC=CC=C3)N4C=CC=C4)C5=CC=C(C=C5)F

InChI

InChI=1S/C29H32FN5O/c1-22-27(29(34-16-5-6-17-34)35(32-22)26-11-9-25(30)10-12-26)28(36)31-15-20-33-18-13-24(14-19-33)21-23-7-3-2-4-8-23/h2-12,16-17,24H,13-15,18-21H2,1H3,(H,31,36)