(4-methylphenyl)-[4-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (4-methylphenyl)-[4-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)carbonylpiperazin-1-yl]methanone Openeye Name: [4-[1-phenyl-3-(2-thienyl)pyrazole-4-carbonyl]piperazin-1-yl]-(p-tolyl)methanone CAS Name: (4-methylphenyl)-[4-[oxo-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-methylphenyl)-[4-(1-phenyl-3-thiophen-2-ylpyrazole-4-carbonyl)piperazin-1-yl]methanone Traditional Name: [4-[1-phenyl-3-(2-thienyl)pyrazole-4-carbonyl]piperazino]-(p-tolyl)methanone Formula: C26H24N4O2S MolecularWeight: 456.55936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C26H24N4O2S/c1-19-9-11-20(12-10-19)25(31)28-13-15-29(16-14-28)26(32)22-18-30(21-6-3-2-4-7-21)27-24(22)23-8-5-17-33-23/h2-12,17-18H,13-16H2,1H3