N-[4-(azepan-1-ylcarbonyl)-2-(2-chlorophenyl)pyrazol-3-yl]ethanamide

Systemtic Name: N-[4-(azepan-1-ylcarbonyl)-2-(2-chlorophenyl)pyrazol-3-yl]ethanamide Openeye Name: N-[4-(azepane-1-carbonyl)-2-(2-chlorophenyl)pyrazol-3-yl]acetamide CAS Name: N-[4-[1-azepanyl(oxo)methyl]-2-(2-chlorophenyl)-3-pyrazolyl]acetamide IUPAC Name: N-[4-(azepane-1-carbonyl)-2-(2-chlorophenyl)pyrazol-3-yl]acetamide Traditional Name: N-[4-(azepane-1-carbonyl)-2-(2-chlorophenyl)pyrazol-3-yl]acetamide Formula: C18H21ClN4O2 MolecularWeight: 360.83794

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=NN1C2=CC=CC=C2Cl)C(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)NC1=C(C=NN1C2=CC=CC=C2Cl)C(=O)N3CCCCCC3

InChI

InChI=1S/C18H21ClN4O2/c1-13(24)21-17-14(18(25)22-10-6-2-3-7-11-22)12-20-23(17)16-9-5-4-8-15(16)19/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,21,24)