[4-(phenylmethyl)piperidin-1-yl]-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methanone

Systemtic Name: [4-(phenylmethyl)piperidin-1-yl]-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methanone Openeye Name: (4-benzyl-1-piperidyl)-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methanone CAS Name: [4-(phenylmethyl)-1-piperidinyl]-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)methanone Traditional Name: (4-benzylpiperidino)-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)methanone Formula: C26H26N4O MolecularWeight: 410.51084

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C26H26N4O/c31-26(29-17-13-22(14-18-29)19-21-9-3-1-4-10-21)24-20-27-30(23-11-5-2-6-12-23)25(24)28-15-7-8-16-28/h1-12,15-16,20,22H,13-14,17-19H2