4-(2,6-dimethylphenyl)-3-methyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(2,6-dimethylphenyl)-3-methyl-1H-1,2,4-triazol-5-one Openeye Name: 4-(2,6-dimethylphenyl)-3-methyl-1H-1,2,4-triazol-5-one CAS Name: 4-(2,6-dimethylphenyl)-3-methyl-1H-1,2,4-triazol-5-one IUPAC Name: 4-(2,6-dimethylphenyl)-3-methyl-1H-1,2,4-triazol-5-one Traditional Name: 4-(2,6-dimethylphenyl)-3-methyl-1H-1,2,4-triazol-5-one Formula: C11H13N3O MolecularWeight: 203.24042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NNC2=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NNC2=O)C

InChI

InChI=1S/C11H13N3O/c1-7-5-4-6-8(2)10(7)14-9(3)12-13-11(14)15/h4-6H,1-3H3,(H,13,15)