azepan-1-yl-[1-[1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[1-(3-chlorophenyl)-5-ethyl-pyrazol-4-yl]carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[1-(3-chlorophenyl)-5-ethyl-pyrazole-4-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[1-(3-chlorophenyl)-5-ethyl-4-pyrazolyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[1-(3-chlorophenyl)-5-ethylpyrazole-4-carbonyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[1-(3-chlorophenyl)-5-ethyl-pyrazole-4-carbonyl]-4-piperidyl]methanone Formula: C24H31ClN4O2 MolecularWeight: 442.98154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C24H31ClN4O2/c1-2-22-21(17-26-29(22)20-9-7-8-19(25)16-20)24(31)28-14-10-18(11-15-28)23(30)27-12-5-3-4-6-13-27/h7-9,16-18H,2-6,10-15H2,1H3