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

Systemtic Name: [2-(4-methylphenyl)-5-thiophen-2-yl-pyrazol-3-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[2-(p-tolyl)-5-(2-thienyl)pyrazol-3-yl]methanone CAS Name: [2-(4-methylphenyl)-5-thiophen-2-yl-3-pyrazolyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[2-(4-methylphenyl)-5-thiophen-2-ylpyrazol-3-yl]methanone Traditional Name: (4-benzylpiperazino)-[2-(p-tolyl)-5-(2-thienyl)pyrazol-3-yl]methanone Formula: C26H26N4OS MolecularWeight: 442.57584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H26N4OS/c1-20-9-11-22(12-10-20)30-24(18-23(27-30)25-8-5-17-32-25)26(31)29-15-13-28(14-16-29)19-21-6-3-2-4-7-21/h2-12,17-18H,13-16,19H2,1H3