2-[2-(1,3-benzodioxol-5-yl)-2-cyano-ethanoyl]-N-(4-chloranyl-3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonamide

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)-2-cyano-ethanoyl]-N-(4-chloranyl-3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonamide Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)-2-cyano-acetyl]-N-(4-chloro-3-methyl-isoxazol-5-yl)thiophene-3-sulfonamide CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-2-cyano-1-oxoethyl]-N-(4-chloro-3-methyl-5-isoxazolyl)-3-thiophenesulfonamide IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)-2-cyanoacetyl]-N-(4-chloro-3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonamide Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)-2-cyano-acetyl]-N-(4-chloro-3-methyl-isoxazol-5-yl)thiophene-3-sulfonamide Formula: C18H12ClN3O6S2 MolecularWeight: 465.88738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1Cl)NS(=O)(=O)C2=C(SC=C2)C(=O)C(C#N)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NOC(=C1Cl)NS(=O)(=O)C2=C(SC=C2)C(=O)C(C#N)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H12ClN3O6S2/c1-9-15(19)18(28-21-9)22-30(24,25)14-4-5-29-17(14)16(23)11(7-20)10-2-3-12-13(6-10)27-8-26-12/h2-6,11,22H,8H2,1H3