7-ethoxy-5-(4-ethoxyphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-ethoxy-5-(4-ethoxyphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-ethoxy-5-(4-ethoxyphenyl)-2-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-ethoxy-5-(4-ethoxyphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-ethoxy-5-(4-ethoxyphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-ethoxy-5-p-phenetyl-2-(4-pyridyl)-4H-1,3,4-benzotriazepine Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=NC=C4)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=NC=C4)OCC

InChI

InChI=1S/C23H22N4O2/c1-3-28-18-7-5-16(6-8-18)22-20-15-19(29-4-2)9-10-21(20)25-23(27-26-22)17-11-13-24-14-12-17/h5-15,26H,3-4H2,1-2H3