2-[[5-(1,3-benzodioxol-5-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-(1,3-benzodioxol-5-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-(1,3-benzodioxol-5-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(1,3-benzodioxol-5-ylamino)-1,3,4-thiadiazol-2-yl]thio]acetate IUPAC Name: 2-[[5-(1,3-benzodioxol-5-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(1,3-benzodioxol-5-ylamino)-1,3,4-thiadiazol-2-yl]thio]acetate Formula: C11H8N3O4S2- MolecularWeight: 310.32892

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=NN=C(S3)SCC(=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=NN=C(S3)SCC(=O)[O-]

InChI

InChI=1S/C11H9N3O4S2/c15-9(16)4-19-11-14-13-10(20-11)12-6-1-2-7-8(3-6)18-5-17-7/h1-3H,4-5H2,(H,12,13)(H,15,16)/p-1