2-(3,4-dimethoxyphenyl)-8-propan-2-yl-4-pyridin-4-yl-1H-1,3,5-benzotriazepine

Systemtic Name: 2-(3,4-dimethoxyphenyl)-8-propan-2-yl-4-pyridin-4-yl-1H-1,3,5-benzotriazepine Openeye Name: 2-(3,4-dimethoxyphenyl)-8-isopropyl-4-(4-pyridyl)-1H-1,3,5-benzotriazepine CAS Name: 2-(3,4-dimethoxyphenyl)-8-propan-2-yl-4-pyridin-4-yl-1H-1,3,5-benzotriazepine IUPAC Name: 2-(3,4-dimethoxyphenyl)-8-propan-2-yl-4-pyridin-4-yl-1H-1,3,5-benzotriazepine Traditional Name: 2-(3,4-dimethoxyphenyl)-8-isopropyl-4-(4-pyridyl)-1H-1,3,5-benzotriazepine Formula: C24H24N4O2 MolecularWeight: 400.47296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N=C(N=C(N2)C3=CC(=C(C=C3)OC)OC)C4=CC=NC=C4

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N=C(N=C(N2)C3=CC(=C(C=C3)OC)OC)C4=CC=NC=C4

InChI

InChI=1S/C24H24N4O2/c1-15(2)17-5-7-19-20(13-17)27-24(18-6-8-21(29-3)22(14-18)30-4)28-23(26-19)16-9-11-25-12-10-16/h5-15H,1-4H3,(H,26,27,28)