oxan-4-yl-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1,4-diazepan-1-yl]methanone

Systemtic Name: oxan-4-yl-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1,4-diazepan-1-yl]methanone Openeye Name: tetrahydropyran-4-yl-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1,4-diazepan-1-yl]methanone CAS Name: 4-oxanyl-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1,4-diazepan-1-yl]methanone IUPAC Name: oxan-4-yl-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1,4-diazepan-1-yl]methanone Traditional Name: tetrahydropyran-4-yl-[4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]-1,4-diazepan-1-yl]methanone Formula: C19H23F3N4O2 MolecularWeight: 396.40673

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2CCOCC2)C3=NC4=C(N3)C=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2CCOCC2)C3=NC4=C(N3)C=C(C=C4)C(F)(F)F

InChI

InChI=1S/C19H23F3N4O2/c20-19(21,22)14-2-3-15-16(12-14)24-18(23-15)26-7-1-6-25(8-9-26)17(27)13-4-10-28-11-5-13/h2-3,12-13H,1,4-11H2,(H,23,24)