[2-(3-methylphenyl)-5-thiophen-2-yl-pyrazol-3-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: [2-(3-methylphenyl)-5-thiophen-2-yl-pyrazol-3-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-[2-(m-tolyl)-5-(2-thienyl)pyrazol-3-yl]methanone CAS Name: [2-(3-methylphenyl)-5-thiophen-2-yl-3-pyrazolyl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-[2-(3-methylphenyl)-5-thiophen-2-ylpyrazol-3-yl]methanone Traditional Name: (4-benzylpiperidino)-[2-(m-tolyl)-5-(2-thienyl)pyrazol-3-yl]methanone Formula: C27H27N3OS MolecularWeight: 441.58778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H27N3OS/c1-20-7-5-10-23(17-20)30-25(19-24(28-30)26-11-6-16-32-26)27(31)29-14-12-22(13-15-29)18-21-8-3-2-4-9-21/h2-11,16-17,19,22H,12-15,18H2,1H3