5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-3-(4-methylpiperazin-1-yl)-1,2,4-thiadiazole

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-3-(4-methylpiperazin-1-yl)-1,2,4-thiadiazole Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-3-(4-methylpiperazin-1-yl)-1,2,4-thiadiazole CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-3-(4-methyl-1-piperazinyl)-1,2,4-thiadiazole IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-3-(4-methylpiperazin-1-yl)-1,2,4-thiadiazole Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfonyl)-3-(4-methylpiperazino)-1,2,4-thiadiazole Formula: C16H20N4O4S2 MolecularWeight: 396.4844

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NSC(=N2)S(=O)(=O)CC3COC4=CC=CC=C4O3

Isomeric SMILES

CN1CCN(CC1)C2=NSC(=N2)S(=O)(=O)CC3COC4=CC=CC=C4O3

InChI

InChI=1S/C16H20N4O4S2/c1-19-6-8-20(9-7-19)15-17-16(25-18-15)26(21,22)11-12-10-23-13-4-2-3-5-14(13)24-12/h2-5,12H,6-11H2,1H3