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

Systemtic Name: [2-(3-chlorophenyl)-5-thiophen-2-yl-pyrazol-3-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[2-(3-chlorophenyl)-5-(2-thienyl)pyrazol-3-yl]methanone CAS Name: [2-(3-chlorophenyl)-5-thiophen-2-yl-3-pyrazolyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[2-(3-chlorophenyl)-5-thiophen-2-ylpyrazol-3-yl]methanone Traditional Name: (4-benzylpiperazino)-[2-(3-chlorophenyl)-5-(2-thienyl)pyrazol-3-yl]methanone Formula: C25H23ClN4OS MolecularWeight: 462.99432

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=NN3C4=CC(=CC=C4)Cl)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=NN3C4=CC(=CC=C4)Cl)C5=CC=CS5

InChI

InChI=1S/C25H23ClN4OS/c26-20-8-4-9-21(16-20)30-23(17-22(27-30)24-10-5-15-32-24)25(31)29-13-11-28(12-14-29)18-19-6-2-1-3-7-19/h1-10,15-17H,11-14,18H2