2-[(3-tert-butyl-1,2,4-triazol-1-yl)methyl]propanedinitrile

Systemtic Name: 2-[(3-tert-butyl-1,2,4-triazol-1-yl)methyl]propanedinitrile Openeye Name: 2-[(3-tert-butyl-1,2,4-triazol-1-yl)methyl]propanedinitrile CAS Name: 2-[(3-tert-butyl-1,2,4-triazol-1-yl)methyl]propanedinitrile IUPAC Name: 2-[(3-tert-butyl-1,2,4-triazol-1-yl)methyl]propanedinitrile Traditional Name: 2-[(3-tert-butyl-1,2,4-triazol-1-yl)methyl]malononitrile Formula: C10H13N5 MolecularWeight: 203.24372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=N1)CC(C#N)C#N

Isomeric SMILES

CC(C)(C)C1=NN(C=N1)CC(C#N)C#N

InChI

InChI=1S/C10H13N5/c1-10(2,3)9-13-7-15(14-9)6-8(4-11)5-12/h7-8H,6H2,1-3H3