5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-N-(4-methoxyphenyl)-1,2,4-thiadiazol-3-amine

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-N-(4-methoxyphenyl)-1,2,4-thiadiazol-3-amine Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-N-(4-methoxyphenyl)-1,2,4-thiadiazol-3-amine CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-N-(4-methoxyphenyl)-1,2,4-thiadiazol-3-amine IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-N-(4-methoxyphenyl)-1,2,4-thiadiazol-3-amine Traditional Name: [5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-1,2,4-thiadiazol-3-yl]-(4-methoxyphenyl)amine Formula: C18H17N3O5S2 MolecularWeight: 419.47468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NSC(=N2)S(=O)(=O)CC3COC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NSC(=N2)S(=O)(=O)CC3COC4=CC=CC=C4O3

InChI

InChI=1S/C18H17N3O5S2/c1-24-13-8-6-12(7-9-13)19-17-20-18(27-21-17)28(22,23)11-14-10-25-15-4-2-3-5-16(15)26-14/h2-9,14H,10-11H2,1H3,(H,19,21)