2-pyridin-4-yl-5-[4-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine

Systemtic Name: 2-pyridin-4-yl-5-[4-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-pyridyl)-5-[4-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine CAS Name: 2-pyridin-4-yl-5-[4-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine IUPAC Name: 2-pyridin-4-yl-5-[4-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine Traditional Name: 2-(4-pyridyl)-5-[4-(trifluoromethyl)phenyl]-4H-1,3,4-benzotriazepine Formula: C20H13F3N4 MolecularWeight: 366.33923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(NN=C(N=C2C=C1)C3=CC=NC=C3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1=CC2=C(NN=C(N=C2C=C1)C3=CC=NC=C3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H13F3N4/c21-20(22,23)15-7-5-13(6-8-15)18-16-3-1-2-4-17(16)25-19(27-26-18)14-9-11-24-12-10-14/h1-12,26H