(E)-3-(3-nitrophenyl)-N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(3-nitrophenyl)-N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-N-[[4-(tetrahydrofuran-2-ylmethylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-N-[[4-(2-oxolanylmethylsulfamoyl)anilino]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(3-nitrophenyl)-N-[[4-(oxolan-2-ylmethylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(3-nitrophenyl)-N-[[4-(tetrahydrofurfurylsulfamoyl)phenyl]thiocarbamoyl]acrylamide Formula: C21H22N4O6S2 MolecularWeight: 490.55258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)CNS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O6S2/c26-20(11-6-15-3-1-4-17(13-15)25(27)28)24-21(32)23-16-7-9-19(10-8-16)33(29,30)22-14-18-5-2-12-31-18/h1,3-4,6-11,13,18,22H,2,5,12,14H2,(H2,23,24,26,32)/b11-6+