7-methoxy-5-pyridin-3-yl-2-pyridin-4-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-methoxy-5-pyridin-3-yl-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-methoxy-5-(3-pyridyl)-2-(4-pyridyl)-4H-1,3,4-benzotriazepine CAS Name: 7-methoxy-5-(3-pyridinyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-methoxy-5-pyridin-3-yl-2-pyridin-4-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-methoxy-5-(3-pyridyl)-2-(4-pyridyl)-4H-1,3,4-benzotriazepine Formula: C19H15N5O MolecularWeight: 329.3553

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(NN=C(N=C2C=C1)C3=CC=NC=C3)C4=CN=CC=C4

Isomeric SMILES

COC1=CC2=C(NN=C(N=C2C=C1)C3=CC=NC=C3)C4=CN=CC=C4

InChI

InChI=1S/C19H15N5O/c1-25-15-4-5-17-16(11-15)18(14-3-2-8-21-12-14)23-24-19(22-17)13-6-9-20-10-7-13/h2-12,23H,1H3