5-[1-(2-azanylpyridin-3-yl)-5-methyl-1,2,3-triazol-4-yl]-2-propyl-3H-isoindol-1-one

Systemtic Name: 5-[1-(2-azanylpyridin-3-yl)-5-methyl-1,2,3-triazol-4-yl]-2-propyl-3H-isoindol-1-one Openeye Name: 5-[1-(2-amino-3-pyridyl)-5-methyl-triazol-4-yl]-2-propyl-isoindolin-1-one CAS Name: 5-[1-(2-amino-3-pyridinyl)-5-methyl-4-triazolyl]-2-propyl-3H-isoindol-1-one IUPAC Name: 5-[1-(2-aminopyridin-3-yl)-5-methyltriazol-4-yl]-2-propyl-3H-isoindol-1-one Traditional Name: 5-[1-(2-amino-3-pyridyl)-5-methyl-triazol-4-yl]-2-propyl-isoindolin-1-one Formula: C19H20N6O MolecularWeight: 348.4017

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC2=C(C1=O)C=CC(=C2)C3=C(N(N=N3)C4=C(N=CC=C4)N)C

Isomeric SMILES

CCCN1CC2=C(C1=O)C=CC(=C2)C3=C(N(N=N3)C4=C(N=CC=C4)N)C

InChI

InChI=1S/C19H20N6O/c1-3-9-24-11-14-10-13(6-7-15(14)19(24)26)17-12(2)25(23-22-17)16-5-4-8-21-18(16)20/h4-8,10H,3,9,11H2,1-2H3,(H2,20,21)