4-(2-azidoethyl)-5-methyl-2-(3-methylphenyl)-1,2,4-triazol-3-one

Systemtic Name: 4-(2-azidoethyl)-5-methyl-2-(3-methylphenyl)-1,2,4-triazol-3-one Openeye Name: 4-(2-azidoethyl)-5-methyl-2-(m-tolyl)-1,2,4-triazol-3-one CAS Name: 4-(2-azidoethyl)-5-methyl-2-(3-methylphenyl)-1,2,4-triazol-3-one IUPAC Name: 4-(2-azidoethyl)-5-methyl-2-(3-methylphenyl)-1,2,4-triazol-3-one Traditional Name: 4-(2-azidoethyl)-5-methyl-2-(m-tolyl)-1,2,4-triazol-3-one Formula: C12H14N6O MolecularWeight: 258.27916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)N(C(=N2)C)CCN=[N+]=[N-]

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)N(C(=N2)C)CCN=[N+]=[N-]

InChI

InChI=1S/C12H14N6O/c1-9-4-3-5-11(8-9)18-12(19)17(10(2)15-18)7-6-14-16-13/h3-5,8H,6-7H2,1-2H3