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

Systemtic Name: 2-(4-tert-butylphenyl)-7-methoxy-5-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-tert-butylphenyl)-7-methoxy-5-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 2-(4-tert-butylphenyl)-7-methoxy-5-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 2-(4-tert-butylphenyl)-7-methoxy-5-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 2-(4-tert-butylphenyl)-7-methoxy-5-(4-pyridyl)-4H-1,3,4-benzotriazepine Formula: C24H24N4O MolecularWeight: 384.47356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24N4O/c1-24(2,3)18-7-5-17(6-8-18)23-26-21-10-9-19(29-4)15-20(21)22(27-28-23)16-11-13-25-14-12-16/h5-15,27H,1-4H3