5-[3-(4-methoxyphenoxy)propylsulfonyl]-1H-1,2,4-triazol-3-amine

Systemtic Name: 5-[3-(4-methoxyphenoxy)propylsulfonyl]-1H-1,2,4-triazol-3-amine Openeye Name: 5-[3-(4-methoxyphenoxy)propylsulfonyl]-1H-1,2,4-triazol-3-amine CAS Name: 5-[3-(4-methoxyphenoxy)propylsulfonyl]-1H-1,2,4-triazol-3-amine IUPAC Name: 5-[3-(4-methoxyphenoxy)propylsulfonyl]-1H-1,2,4-triazol-3-amine Traditional Name: [5-[3-(4-methoxyphenoxy)propylsulfonyl]-1H-1,2,4-triazol-3-yl]amine Formula: C12H16N4O4S MolecularWeight: 312.34484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCCS(=O)(=O)C2=NC(=NN2)N

Isomeric SMILES

COC1=CC=C(C=C1)OCCCS(=O)(=O)C2=NC(=NN2)N

InChI

InChI=1S/C12H16N4O4S/c1-19-9-3-5-10(6-4-9)20-7-2-8-21(17,18)12-14-11(13)15-16-12/h3-6H,2,7-8H2,1H3,(H3,13,14,15,16)