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

Systemtic Name: azepan-1-yl-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]methanone Openeye Name: azepan-1-yl-[5-chloro-3-methyl-1-(p-tolylmethyl)pyrazol-4-yl]methanone CAS Name: 1-azepanyl-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]methanone IUPAC Name: azepan-1-yl-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]methanone Traditional Name: azepan-1-yl-[5-chloro-3-methyl-1-(4-methylbenzyl)pyrazol-4-yl]methanone Formula: C19H24ClN3O MolecularWeight: 345.86636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)N3CCCCCC3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C19H24ClN3O/c1-14-7-9-16(10-8-14)13-23-18(20)17(15(2)21-23)19(24)22-11-5-3-4-6-12-22/h7-10H,3-6,11-13H2,1-2H3