8-ethyl-4-(4-fluorophenyl)-2-pyridin-4-yl-1H-1,3,5-benzotriazepine

Systemtic Name: 8-ethyl-4-(4-fluorophenyl)-2-pyridin-4-yl-1H-1,3,5-benzotriazepine Openeye Name: 8-ethyl-4-(4-fluorophenyl)-2-(4-pyridyl)-1H-1,3,5-benzotriazepine CAS Name: 8-ethyl-4-(4-fluorophenyl)-2-pyridin-4-yl-1H-1,3,5-benzotriazepine IUPAC Name: 8-ethyl-4-(4-fluorophenyl)-2-pyridin-4-yl-1H-1,3,5-benzotriazepine Traditional Name: 8-ethyl-4-(4-fluorophenyl)-2-(4-pyridyl)-1H-1,3,5-benzotriazepine Formula: C21H17FN4 MolecularWeight: 344.384883

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(N=C(N2)C3=CC=NC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(N=C(N2)C3=CC=NC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H17FN4/c1-2-14-3-8-18-19(13-14)25-21(16-9-11-23-12-10-16)26-20(24-18)15-4-6-17(22)7-5-15/h3-13H,2H2,1H3,(H,24,25,26)