1-(azepan-1-yl)-2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone Formula: C15H19BrF3N3O MolecularWeight: 394.23007

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CN2C(=C(C(=N2)C(F)(F)F)Br)C3CC3

Isomeric SMILES

C1CCCN(CC1)C(=O)CN2C(=C(C(=N2)C(F)(F)F)Br)C3CC3

InChI

InChI=1S/C15H19BrF3N3O/c16-12-13(10-5-6-10)22(20-14(12)15(17,18)19)9-11(23)21-7-3-1-2-4-8-21/h10H,1-9H2