7-methyl-5-(4-propoxyphenyl)-2-pyridin-4-yl-4H-1,3,4-benzotriazepine

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=NC=C4)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=NN2)C4=CC=NC=C4)C

InChI

InChI=1S/C23H22N4O/c1-3-14-28-19-7-5-17(6-8-19)22-20-15-16(2)4-9-21(20)25-23(27-26-22)18-10-12-24-13-11-18/h4-13,15,26H,3,14H2,1-2H3