5-[4-(4-methoxyphenyl)phenyl]-2-pyridin-3-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 5-[4-(4-methoxyphenyl)phenyl]-2-pyridin-3-yl-4H-1,3,4-benzotriazepine Openeye Name: 5-[4-(4-methoxyphenyl)phenyl]-2-(3-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 5-[4-(4-methoxyphenyl)phenyl]-2-(3-pyridinyl)-4H-1,3,4-benzotriazepine IUPAC Name: 5-[4-(4-methoxyphenyl)phenyl]-2-pyridin-3-yl-4H-1,3,4-benzotriazepine Traditional Name: 5-[4-(4-methoxyphenyl)phenyl]-2-(3-pyridyl)-4H-1,3,4-benzotriazepine Formula: C26H20N4O MolecularWeight: 404.4632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(C=C2)C3=C4C=CC=CC4=NC(=NN3)C5=CN=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(C=C2)C3=C4C=CC=CC4=NC(=NN3)C5=CN=CC=C5

InChI

InChI=1S/C26H20N4O/c1-31-22-14-12-19(13-15-22)18-8-10-20(11-9-18)25-23-6-2-3-7-24(23)28-26(30-29-25)21-5-4-16-27-17-21/h2-17,29H,1H3