(E)-3-(4-ethoxyphenyl)-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-ethoxyphenyl)-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-ethoxyphenyl)-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-ethoxyphenyl)-N-[[4-(propylsulfamoyl)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-ethoxyphenyl)-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-p-phenetyl-N-[[4-(propylsulfamoyl)phenyl]thiocarbamoyl]acrylamide Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)OCC

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)OCC

InChI

InChI=1S/C21H25N3O4S2/c1-3-15-22-30(26,27)19-12-8-17(9-13-19)23-21(29)24-20(25)14-7-16-5-10-18(11-6-16)28-4-2/h5-14,22H,3-4,15H2,1-2H3,(H2,23,24,25,29)/b14-7+