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

Systemtic Name: [2-(2,4-dimethylphenyl)-5-thiophen-2-yl-pyrazol-3-yl]-[4-(2-methylphenyl)piperazin-1-yl]methanone Openeye Name: [2-(2,4-dimethylphenyl)-5-(2-thienyl)pyrazol-3-yl]-[4-(o-tolyl)piperazin-1-yl]methanone CAS Name: [2-(2,4-dimethylphenyl)-5-thiophen-2-yl-3-pyrazolyl]-[4-(2-methylphenyl)-1-piperazinyl]methanone IUPAC Name: [2-(2,4-dimethylphenyl)-5-thiophen-2-ylpyrazol-3-yl]-[4-(2-methylphenyl)piperazin-1-yl]methanone Traditional Name: [2-(2,4-dimethylphenyl)-5-(2-thienyl)pyrazol-3-yl]-[4-(o-tolyl)piperazino]methanone Formula: C27H28N4OS MolecularWeight: 456.60242

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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)C5=CC=CC=C5C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=CS3)C(=O)N4CCN(CC4)C5=CC=CC=C5C)C

InChI

InChI=1S/C27H28N4OS/c1-19-10-11-24(21(3)17-19)31-25(18-22(28-31)26-9-6-16-33-26)27(32)30-14-12-29(13-15-30)23-8-5-4-7-20(23)2/h4-11,16-18H,12-15H2,1-3H3