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

Systemtic Name: 7-ethoxy-5-(4-methoxyphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-ethoxy-5-(4-methoxyphenyl)-2-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-ethoxy-5-(4-methoxyphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-ethoxy-5-(4-methoxyphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-ethoxy-5-(4-methoxyphenyl)-2-(4-pyridyl)-4H-1,3,4-benzotriazepine Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(NN=C(N=C2C=C1)C3=CC=NC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC1=CC2=C(NN=C(N=C2C=C1)C3=CC=NC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H20N4O2/c1-3-28-18-8-9-20-19(14-18)21(15-4-6-17(27-2)7-5-15)25-26-22(24-20)16-10-12-23-13-11-16/h4-14,25H,3H2,1-2H3