2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-methylsulfanyl-butanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-methylsulfanyl-butanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-methylsulfanyl-butanamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(methylthio)butanamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-methylsulfanylbutanamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-(methylthio)butyramide Formula: C17H22N4O5S3 MolecularWeight: 458.57538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)C(CCSC)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)C(CCSC)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H22N4O5S3/c1-3-15-19-20-17(28-15)18-16(22)12(6-9-27-2)21-29(23,24)11-4-5-13-14(10-11)26-8-7-25-13/h4-5,10,12,21H,3,6-9H2,1-2H3,(H,18,20,22)