(4-phenylmethoxypiperidin-1-yl)-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methanone

Systemtic Name: (4-phenylmethoxypiperidin-1-yl)-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methanone Openeye Name: (4-benzyloxy-1-piperidyl)-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methanone CAS Name: (4-phenylmethoxy-1-piperidinyl)-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]methanone IUPAC Name: (1-benzyl-3-thiophen-2-ylpyrazol-4-yl)-(4-phenylmethoxypiperidin-1-yl)methanone Traditional Name: (4-benzoxypiperidino)-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methanone Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OCC2=CC=CC=C2)C(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1OCC2=CC=CC=C2)C(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C27H27N3O2S/c31-27(29-15-13-23(14-16-29)32-20-22-10-5-2-6-11-22)24-19-30(18-21-8-3-1-4-9-21)28-26(24)25-12-7-17-33-25/h1-12,17,19,23H,13-16,18,20H2