7-methoxy-2-(4-methylphenyl)-5-pyridin-4-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-methoxy-2-(4-methylphenyl)-5-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-methoxy-2-(p-tolyl)-5-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-methoxy-2-(4-methylphenyl)-5-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-methoxy-2-(4-methylphenyl)-5-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-methoxy-2-(p-tolyl)-5-(4-pyridyl)-4H-1,3,4-benzotriazepine Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)OC)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)OC)C4=CC=NC=C4

InChI

InChI=1S/C21H18N4O/c1-14-3-5-16(6-4-14)21-23-19-8-7-17(26-2)13-18(19)20(24-25-21)15-9-11-22-12-10-15/h3-13,24H,1-2H3