azepan-1-yl-[1-[1-(3-chlorophenyl)-5-propan-2-yl-pyrazol-4-yl]carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[1-(3-chlorophenyl)-5-propan-2-yl-pyrazol-4-yl]carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[1-(3-chlorophenyl)-5-isopropyl-pyrazole-4-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[1-(3-chlorophenyl)-5-propan-2-yl-4-pyrazolyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[1-(3-chlorophenyl)-5-propan-2-ylpyrazole-4-carbonyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[1-(3-chlorophenyl)-5-isopropyl-pyrazole-4-carbonyl]-4-piperidyl]methanone Formula: C25H33ClN4O2 MolecularWeight: 457.00812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H33ClN4O2/c1-18(2)23-22(17-27-30(23)21-9-7-8-20(26)16-21)25(32)29-14-10-19(11-15-29)24(31)28-12-5-3-4-6-13-28/h7-9,16-19H,3-6,10-15H2,1-2H3