2-(5-isocyano-3,6-dimethyl-pyridin-2-yl)-4,5-dimethyl-1,2,4-triazol-3-one

Systemtic Name: 2-(5-isocyano-3,6-dimethyl-pyridin-2-yl)-4,5-dimethyl-1,2,4-triazol-3-one Openeye Name: 2-(5-isocyano-3,6-dimethyl-2-pyridyl)-4,5-dimethyl-1,2,4-triazol-3-one CAS Name: 2-(5-isocyano-3,6-dimethyl-2-pyridinyl)-4,5-dimethyl-1,2,4-triazol-3-one IUPAC Name: 2-(5-isocyano-3,6-dimethylpyridin-2-yl)-4,5-dimethyl-1,2,4-triazol-3-one Traditional Name: 2-(5-isocyano-3,6-dimethyl-2-pyridyl)-4,5-dimethyl-1,2,4-triazol-3-one Formula: C12H13N5O MolecularWeight: 243.26452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1N2C(=O)N(C(=N2)C)C)C)[N+]#[C-]

Isomeric SMILES

CC1=CC(=C(N=C1N2C(=O)N(C(=N2)C)C)C)[N+]#[C-]

InChI

InChI=1S/C12H13N5O/c1-7-6-10(13-4)8(2)14-11(7)17-12(18)16(5)9(3)15-17/h6H,1-3,5H3