2-(4-bromophenyl)-7-chloranyl-5-pyridin-3-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 2-(4-bromophenyl)-7-chloranyl-5-pyridin-3-yl-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-bromophenyl)-7-chloro-5-(3-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 2-(4-bromophenyl)-7-chloro-5-(3-pyridinyl)-4H-1,3,4-benzotriazepine IUPAC Name: 2-(4-bromophenyl)-7-chloro-5-pyridin-3-yl-4H-1,3,4-benzotriazepine Traditional Name: 2-(4-bromophenyl)-7-chloro-5-(3-pyridyl)-4H-1,3,4-benzotriazepine Formula: C19H12BrClN4 MolecularWeight: 411.68238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=C(C=C4)Br)Cl

Isomeric SMILES

C1=CC(=CN=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=C(C=C4)Br)Cl

InChI

InChI=1S/C19H12BrClN4/c20-14-5-3-12(4-6-14)19-23-17-8-7-15(21)10-16(17)18(24-25-19)13-2-1-9-22-11-13/h1-11,24H