1-(phenylmethyl)-4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane

Systemtic Name: 1-(phenylmethyl)-4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane Openeye Name: 1-benzyl-4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepane CAS Name: 1-(phenylmethyl)-4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepane IUPAC Name: 1-benzyl-4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane Traditional Name: 1-benzyl-4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepane Formula: C18H20F3N3 MolecularWeight: 335.36671

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC=C(C=C2)C(F)(F)F)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C2=NC=C(C=C2)C(F)(F)F)CC3=CC=CC=C3

InChI

InChI=1S/C18H20F3N3/c19-18(20,21)16-7-8-17(22-13-16)24-10-4-9-23(11-12-24)14-15-5-2-1-3-6-15/h1-3,5-8,13H,4,9-12,14H2