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

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]ethanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]acetamide CAS Name: 2-[4-(1-azepanylsulfonyl)-1-piperazinyl]-N-[5-methyl-2-(4-methylphenyl)-3-pyrazolyl]acetamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)piperazino]-N-[5-methyl-2-(p-tolyl)pyrazol-3-yl]acetamide Formula: C23H34N6O3S MolecularWeight: 474.61946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CN3CCN(CC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)NC(=O)CN3CCN(CC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H34N6O3S/c1-19-7-9-21(10-8-19)29-22(17-20(2)25-29)24-23(30)18-26-13-15-28(16-14-26)33(31,32)27-11-5-3-4-6-12-27/h7-10,17H,3-6,11-16,18H2,1-2H3,(H,24,30)