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

Systemtic Name: (E)-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[[4-(cyclohexylsulfamoyl)anilino]-sulfanylidenemethyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[[4-(cyclohexylsulfamoyl)phenyl]carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[[4-(cyclohexylsulfamoyl)phenyl]thiocarbamoyl]-3-(4-nitrophenyl)acrylamide Formula: C22H24N4O5S2 MolecularWeight: 488.57976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5S2/c27-21(15-8-16-6-11-19(12-7-16)26(28)29)24-22(32)23-17-9-13-20(14-10-17)33(30,31)25-18-4-2-1-3-5-18/h6-15,18,25H,1-5H2,(H2,23,24,27,32)/b15-8+