3,5-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfanyl)-1,2,4-thiadiazole

Systemtic Name: 3,5-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfanyl)-1,2,4-thiadiazole Openeye Name: 3,5-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfanyl)-1,2,4-thiadiazole CAS Name: 3,5-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethylthio)-1,2,4-thiadiazole IUPAC Name: 3,5-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethylsulfanyl)-1,2,4-thiadiazole Traditional Name: 3,5-bis(2,3-dihydro-1,4-benzodioxin-3-ylmethylthio)-1,2,4-thiadiazole Formula: C20H18N2O4S3 MolecularWeight: 446.56292

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CSC3=NSC(=N3)SCC4COC5=CC=CC=C5O4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CSC3=NSC(=N3)SCC4COC5=CC=CC=C5O4

InChI

InChI=1S/C20H18N2O4S3/c1-3-7-17-15(5-1)23-9-13(25-17)11-27-19-21-20(29-22-19)28-12-14-10-24-16-6-2-4-8-18(16)26-14/h1-8,13-14H,9-12H2