2-(4-bromophenyl)-5-pyridin-3-yl-4H-1,3,4-benzotriazepine

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)Br)C4=CN=CC=C4

Isomeric SMILES

C1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)Br)C4=CN=CC=C4

InChI

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