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

Systemtic Name: 1-pyrimidin-2-yl-4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane Openeye Name: 1-pyrimidin-2-yl-4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepane CAS Name: 1-(2-pyrimidinyl)-4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepane IUPAC Name: 1-pyrimidin-2-yl-4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepane Traditional Name: 1-(2-pyrimidyl)-4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepane Formula: C15H16F3N5 MolecularWeight: 323.31625

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC=CC=N2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN(C1)C2=NC=CC=N2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C15H16F3N5/c16-15(17,18)12-3-4-13(21-11-12)22-7-2-8-23(10-9-22)14-19-5-1-6-20-14/h1,3-6,11H,2,7-10H2