3-(1H-1,2,4-triazol-5-ylamino)-2H-isoquinolin-1-one

Systemtic Name: 3-(1H-1,2,4-triazol-5-ylamino)-2H-isoquinolin-1-one Openeye Name: 3-(1H-1,2,4-triazol-5-ylamino)-2H-isoquinolin-1-one CAS Name: 3-(1H-1,2,4-triazol-5-ylamino)-2H-isoquinolin-1-one IUPAC Name: 3-(1H-1,2,4-triazol-5-ylamino)-2H-isoquinolin-1-one Traditional Name: 3-(1H-1,2,4-triazol-5-ylamino)isocarbostyril Formula: C11H9N5O MolecularWeight: 227.22206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(NC2=O)NC3=NC=NN3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(NC2=O)NC3=NC=NN3

InChI

InChI=1S/C11H9N5O/c17-10-8-4-2-1-3-7(8)5-9(14-10)15-11-12-6-13-16-11/h1-6H,(H3,12,13,14,15,16,17)