azepan-1-yl-[1-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[5-chloro-3-methyl-1-(p-tolylmethyl)pyrazole-4-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carbonyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[5-chloro-3-methyl-1-(4-methylbenzyl)pyrazole-4-carbonyl]-4-piperidyl]methanone Formula: C25H33ClN4O2 MolecularWeight: 457.00812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4)Cl

InChI

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