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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H33ClN4O2/c1-18-23(19(2)30(27-18)17-21-9-5-6-10-22(21)26)25(32)29-15-11-20(12-16-29)24(31)28-13-7-3-4-8-14-28/h5-6,9-10,20H,3-4,7-8,11-17H2,1-2H3