3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(3-methylcyclohexyl)benzamide

Systemtic Name: 3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(3-methylcyclohexyl)benzamide Openeye Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(3-methylcyclohexyl)benzamide CAS Name: 3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(3-methylcyclohexyl)benzamide IUPAC Name: 3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(3-methylcyclohexyl)benzamide Traditional Name: 3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(3-methylcyclohexyl)benzamide Formula: C20H26BrN3O MolecularWeight: 404.34394

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)NC(=O)C2=CC(=CC=C2)CN3C(=C(C(=N3)C)Br)C

Isomeric SMILES

CC1CCCC(C1)NC(=O)C2=CC(=CC=C2)CN3C(=C(C(=N3)C)Br)C

InChI

InChI=1S/C20H26BrN3O/c1-13-6-4-9-18(10-13)22-20(25)17-8-5-7-16(11-17)12-24-15(3)19(21)14(2)23-24/h5,7-8,11,13,18H,4,6,9-10,12H2,1-3H3,(H,22,25)