(E)-3-[4-(methylsulfamoyl)phenyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)prop-2-enamide

Systemtic Name: (E)-3-[4-(methylsulfamoyl)phenyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)prop-2-enamide Openeye Name: (E)-3-[4-(methylsulfamoyl)phenyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)prop-2-enamide CAS Name: (E)-3-[4-(methylsulfamoyl)phenyl]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-2-propenamide IUPAC Name: (E)-3-[4-(methylsulfamoyl)phenyl]-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)prop-2-enamide Traditional Name: (E)-3-[4-(methylsulfamoyl)phenyl]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acrylamide Formula: C18H17N3O3S3 MolecularWeight: 419.54088

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)NC2=CC3=C(C=C2)N=C(S3)SC

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=CC3=C(C=C2)N=C(S3)SC

InChI

InChI=1S/C18H17N3O3S3/c1-19-27(23,24)14-7-3-12(4-8-14)5-10-17(22)20-13-6-9-15-16(11-13)26-18(21-15)25-2/h3-11,19H,1-2H3,(H,20,22)/b10-5+