5-[2-(3,5-dimethylphenoxy)ethylsulfonyl]-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-[2-(3,5-dimethylphenoxy)ethylsulfonyl]-1H-1,2,4-triazol-3-amine Openeye Name: 5-[2-(3,5-dimethylphenoxy)ethylsulfonyl]-1H-1,2,4-triazol-3-amine CAS Name: 5-[2-(3,5-dimethylphenoxy)ethylsulfonyl]-1H-1,2,4-triazol-3-amine IUPAC Name: 5-[2-(3,5-dimethylphenoxy)ethylsulfonyl]-1H-1,2,4-triazol-3-amine Traditional Name: [5-[2-(3,5-dimethylphenoxy)ethylsulfonyl]-1H-1,2,4-triazol-3-yl]amine Formula: C12H16N4O3S MolecularWeight: 296.34544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCS(=O)(=O)C2=NC(=NN2)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCS(=O)(=O)C2=NC(=NN2)N)C

InChI

InChI=1S/C12H16N4O3S/c1-8-5-9(2)7-10(6-8)19-3-4-20(17,18)12-14-11(13)15-16-12/h5-7H,3-4H2,1-2H3,(H3,13,14,15,16)