N-methyl-N-phenyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-methyl-N-phenyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]ethanamide Openeye Name: N-methyl-N-phenyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]acetamide CAS Name: N-methyl-N-phenyl-2-[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-methyl-N-phenyl-2-[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]acetamide Traditional Name: N-methyl-N-phenyl-2-[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]acetamide Formula: C20H23F3N4O MolecularWeight: 392.41803

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CN2CCCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CN2CCCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H23F3N4O/c1-25(17-6-3-2-4-7-17)19(28)15-26-10-5-11-27(13-12-26)18-9-8-16(14-24-18)20(21,22)23/h2-4,6-9,14H,5,10-13,15H2,1H3