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

Systemtic Name: 8-methyl-2-(4-propoxyphenyl)-4-pyridin-4-yl-1H-1,3,5-benzotriazepine Openeye Name: 8-methyl-2-(4-propoxyphenyl)-4-(4-pyridyl)-1H-1,3,5-benzotriazepine CAS Name: 8-methyl-2-(4-propoxyphenyl)-4-pyridin-4-yl-1H-1,3,5-benzotriazepine IUPAC Name: 8-methyl-2-(4-propoxyphenyl)-4-pyridin-4-yl-1H-1,3,5-benzotriazepine Traditional Name: 8-methyl-2-(4-propoxyphenyl)-4-(4-pyridyl)-1H-1,3,5-benzotriazepine Formula: C23H22N4O MolecularWeight: 370.44698

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NC(=NC3=C(N2)C=C(C=C3)C)C4=CC=NC=C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NC(=NC3=C(N2)C=C(C=C3)C)C4=CC=NC=C4

InChI

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