3,5-dimethyl-[1,2,4]triazolo[3,4-a]isoquinoline-6-carbonitrile

Systemtic Name: 3,5-dimethyl-[1,2,4]triazolo[3,4-a]isoquinoline-6-carbonitrile Openeye Name: 3,5-dimethyl-[1,2,4]triazolo[3,4-a]isoquinoline-6-carbonitrile CAS Name: 3,5-dimethyl-[1,2,4]triazolo[3,4-a]isoquinoline-6-carbonitrile IUPAC Name: 3,5-dimethyl-[1,2,4]triazolo[3,4-a]isoquinoline-6-carbonitrile Traditional Name: 3,5-dimethyl-[1,2,4]triazol[3,4-a]isoquinoline-6-carbonitrile Formula: C13H10N4 MolecularWeight: 222.2453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C3=NN=C(N13)C)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2C3=NN=C(N13)C)C#N

InChI

InChI=1S/C13H10N4/c1-8-12(7-14)10-5-3-4-6-11(10)13-16-15-9(2)17(8)13/h3-6H,1-2H3