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

Systemtic Name: azepan-1-yl-[5-methyl-1-(3-methylphenyl)pyrazol-4-yl]methanone Openeye Name: azepan-1-yl-[5-methyl-1-(m-tolyl)pyrazol-4-yl]methanone CAS Name: 1-azepanyl-[5-methyl-1-(3-methylphenyl)-4-pyrazolyl]methanone IUPAC Name: azepan-1-yl-[5-methyl-1-(3-methylphenyl)pyrazol-4-yl]methanone Traditional Name: azepan-1-yl-[5-methyl-1-(m-tolyl)pyrazol-4-yl]methanone Formula: C18H23N3O MolecularWeight: 297.39472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)N3CCCCCC3)C

InChI

InChI=1S/C18H23N3O/c1-14-8-7-9-16(12-14)21-15(2)17(13-19-21)18(22)20-10-5-3-4-6-11-20/h7-9,12-13H,3-6,10-11H2,1-2H3