5,8-dimethyl-6-([1,2,3]triazolo[4,5-c]pyridin-1-yl)-2H-isoquinolin-1-one

Systemtic Name: 5,8-dimethyl-6-([1,2,3]triazolo[4,5-c]pyridin-1-yl)-2H-isoquinolin-1-one Openeye Name: 5,8-dimethyl-6-(triazolo[4,5-c]pyridin-1-yl)-2H-isoquinolin-1-one CAS Name: 5,8-dimethyl-6-(1-triazolo[4,5-c]pyridinyl)-2H-isoquinolin-1-one IUPAC Name: 5,8-dimethyl-6-(triazolo[4,5-c]pyridin-1-yl)-2H-isoquinolin-1-one Traditional Name: 5,8-dimethyl-6-(triazolo[4,5-c]pyridin-1-yl)isocarbostyril Formula: C16H13N5O MolecularWeight: 291.30732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)NC=C2)C)N3C4=C(C=NC=C4)N=N3

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)NC=C2)C)N3C4=C(C=NC=C4)N=N3

InChI

InChI=1S/C16H13N5O/c1-9-7-14(10(2)11-3-6-18-16(22)15(9)11)21-13-4-5-17-8-12(13)19-20-21/h3-8H,1-2H3,(H,18,22)