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

Systemtic Name: [2-(4-methoxyphenyl)-5-thiophen-2-yl-pyrazol-3-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[2-(4-methoxyphenyl)-5-(2-thienyl)pyrazol-3-yl]methanone CAS Name: [2-(4-methoxyphenyl)-5-thiophen-2-yl-3-pyrazolyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[2-(4-methoxyphenyl)-5-thiophen-2-ylpyrazol-3-yl]methanone Traditional Name: (4-benzylpiperazino)-[2-(4-methoxyphenyl)-5-(2-thienyl)pyrazol-3-yl]methanone Formula: C26H26N4O2S MolecularWeight: 458.57524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H26N4O2S/c1-32-22-11-9-21(10-12-22)30-24(18-23(27-30)25-8-5-17-33-25)26(31)29-15-13-28(14-16-29)19-20-6-3-2-4-7-20/h2-12,17-18H,13-16,19H2,1H3