3-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]piperidin-1-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]piperidin-1-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]-1-piperidyl]-3-oxo-propanenitrile CAS Name: 3-[4-[2-methyl-5-(trifluoromethyl)-1-benzimidazolyl]-1-piperidinyl]-3-oxopropanenitrile IUPAC Name: 3-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]piperidin-1-yl]-3-oxopropanenitrile Traditional Name: 3-keto-3-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]piperidino]propionitrile Formula: C17H17F3N4O MolecularWeight: 350.33829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3CCN(CC3)C(=O)CC#N)C=CC(=C2)C(F)(F)F

Isomeric SMILES

CC1=NC2=C(N1C3CCN(CC3)C(=O)CC#N)C=CC(=C2)C(F)(F)F

InChI

InChI=1S/C17H17F3N4O/c1-11-22-14-10-12(17(18,19)20)2-3-15(14)24(11)13-5-8-23(9-6-13)16(25)4-7-21/h2-3,10,13H,4-6,8-9H2,1H3