N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]ethanamide Openeye Name: N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]-2-[4-(2-thienylmethyl)piperazin-1-yl]acetamide CAS Name: N-[5-methyl-2-(4-methylphenyl)-3-pyrazolyl]-2-[4-(thiophen-2-ylmethyl)-1-piperazinyl]acetamide IUPAC Name: N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide Traditional Name: N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]-2-[4-(2-thenyl)piperazino]acetamide Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CN3CCN(CC3)CC4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CN3CCN(CC3)CC4=CC=CS4

InChI

InChI=1S/C22H27N5OS/c1-17-5-7-19(8-6-17)27-21(14-18(2)24-27)23-22(28)16-26-11-9-25(10-12-26)15-20-4-3-13-29-20/h3-8,13-14H,9-12,15-16H2,1-2H3,(H,23,28)