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

Systemtic Name: 8-bromanyl-4-phenyl-2-pyridin-3-yl-1H-1,3,5-benzotriazepine Openeye Name: 8-bromo-4-phenyl-2-(3-pyridyl)-1H-1,3,5-benzotriazepine CAS Name: 8-bromo-4-phenyl-2-(3-pyridinyl)-1H-1,3,5-benzotriazepine IUPAC Name: 8-bromo-4-phenyl-2-pyridin-3-yl-1H-1,3,5-benzotriazepine Traditional Name: 8-bromo-4-phenyl-2-(3-pyridyl)-1H-1,3,5-benzotriazepine Formula: C19H13BrN4 MolecularWeight: 377.23732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)NC(=N2)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)NC(=N2)C4=CN=CC=C4

InChI

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