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

Systemtic Name: 7-methoxy-2-(4-propan-2-ylphenyl)-5-pyridin-3-yl-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-isopropylphenyl)-7-methoxy-5-(3-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-methoxy-2-(4-propan-2-ylphenyl)-5-(3-pyridinyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-methoxy-2-(4-propan-2-ylphenyl)-5-pyridin-3-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-methoxy-2-p-cumenyl-5-(3-pyridyl)-4H-1,3,4-benzotriazepine Formula: C23H22N4O MolecularWeight: 370.44698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22N4O/c1-15(2)16-6-8-17(9-7-16)23-25-21-11-10-19(28-3)13-20(21)22(26-27-23)18-5-4-12-24-14-18/h4-15,26H,1-3H3