2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-(4-sulfamoylphenyl)butanamide

Systemtic Name: 2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-(4-sulfamoylphenyl)butanamide Openeye Name: 2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-(4-sulfamoylphenyl)butanamide CAS Name: 2-[[3-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]phenyl]thio]-N-(4-sulfamoylphenyl)butanamide IUPAC Name: 2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-(4-sulfamoylphenyl)butanamide Traditional Name: 2-[[3-[[(E)-3-phenylacryloyl]amino]phenyl]thio]-N-(4-sulfamoylphenyl)butyramide Formula: C25H25N3O4S2 MolecularWeight: 495.6137

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC(=C2)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC(=C2)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H25N3O4S2/c1-2-23(25(30)28-19-12-14-22(15-13-19)34(26,31)32)33-21-10-6-9-20(17-21)27-24(29)16-11-18-7-4-3-5-8-18/h3-17,23H,2H2,1H3,(H,27,29)(H,28,30)(H2,26,31,32)/b16-11+