4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide

Systemtic Name: 4-(4-iodanyl-3,5-dimethyl-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide Openeye Name: 4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide CAS Name: 4-(4-iodo-3,5-dimethyl-1-pyrazolyl)-N-[2-(trifluoromethyl)phenyl]butanamide IUPAC Name: 4-(4-iodo-3,5-dimethylpyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butanamide Traditional Name: 4-(4-iodo-3,5-dimethyl-pyrazol-1-yl)-N-[2-(trifluoromethyl)phenyl]butyramide Formula: C16H17F3IN3O MolecularWeight: 451.22536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NC2=CC=CC=C2C(F)(F)F)C)I

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NC2=CC=CC=C2C(F)(F)F)C)I

InChI

InChI=1S/C16H17F3IN3O/c1-10-15(20)11(2)23(22-10)9-5-8-14(24)21-13-7-4-3-6-12(13)16(17,18)19/h3-4,6-7H,5,8-9H2,1-2H3,(H,21,24)