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

Systemtic Name: 2-(4-ethoxyphenyl)-7-ethyl-5-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 2-(4-ethoxyphenyl)-7-ethyl-5-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 2-(4-ethoxyphenyl)-7-ethyl-5-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 2-(4-ethoxyphenyl)-7-ethyl-5-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-ethyl-2-p-phenetyl-5-(4-pyridyl)-4H-1,3,4-benzotriazepine Formula: C23H22N4O MolecularWeight: 370.44698

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)OCC)C4=CC=NC=C4

Isomeric SMILES

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)OCC)C4=CC=NC=C4

InChI

InChI=1S/C23H22N4O/c1-3-16-5-10-21-20(15-16)22(17-11-13-24-14-12-17)26-27-23(25-21)18-6-8-19(9-7-18)28-4-2/h5-15,26H,3-4H2,1-2H3