1-(1-isoquinolin-5-yl-5-methyl-1,2,3-triazol-4-yl)ethanone

Systemtic Name: 1-(1-isoquinolin-5-yl-5-methyl-1,2,3-triazol-4-yl)ethanone Openeye Name: 1-[1-(5-isoquinolyl)-5-methyl-triazol-4-yl]ethanone CAS Name: 1-[1-(5-isoquinolinyl)-5-methyl-4-triazolyl]ethanone IUPAC Name: 1-(1-isoquinolin-5-yl-5-methyltriazol-4-yl)ethanone Traditional Name: 1-[1-(5-isoquinolyl)-5-methyl-triazol-4-yl]ethanone Formula: C14H12N4O MolecularWeight: 252.27128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC=CC3=C2C=CN=C3)C(=O)C

Isomeric SMILES

CC1=C(N=NN1C2=CC=CC3=C2C=CN=C3)C(=O)C

InChI

InChI=1S/C14H12N4O/c1-9-14(10(2)19)16-17-18(9)13-5-3-4-11-8-15-7-6-12(11)13/h3-8H,1-2H3