7-bromanyl-2-phenyl-5-pyridin-3-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-bromanyl-2-phenyl-5-pyridin-3-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-bromo-2-phenyl-5-(3-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-bromo-2-phenyl-5-(3-pyridinyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-bromo-2-phenyl-5-pyridin-3-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-bromo-2-phenyl-5-(3-pyridyl)-4H-1,3,4-benzotriazepine Formula: C19H13BrN4 MolecularWeight: 377.23732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)Br)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)Br)C4=CN=CC=C4

InChI

InChI=1S/C19H13BrN4/c20-15-8-9-17-16(11-15)18(14-7-4-10-21-12-14)23-24-19(22-17)13-5-2-1-3-6-13/h1-12,23H