2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]ethanamide

Systemtic Name: 2-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]ethanamide Openeye Name: 2-[4-(azepane-1-carbonyl)-1-piperidyl]-N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]acetamide CAS Name: 2-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-N-[3,5-dimethyl-1-(4-methylphenyl)-4-pyrazolyl]acetamide IUPAC Name: 2-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]acetamide Traditional Name: 2-[4-(azepane-1-carbonyl)piperidino]-N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]acetamide Formula: C26H37N5O2 MolecularWeight: 451.60428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NC(=O)CN3CCC(CC3)C(=O)N4CCCCCC4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NC(=O)CN3CCC(CC3)C(=O)N4CCCCCC4)C

InChI

InChI=1S/C26H37N5O2/c1-19-8-10-23(11-9-19)31-21(3)25(20(2)28-31)27-24(32)18-29-16-12-22(13-17-29)26(33)30-14-6-4-5-7-15-30/h8-11,22H,4-7,12-18H2,1-3H3,(H,27,32)