(E)-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-phenylmethoxy-phenyl]ethyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-phenylmethoxy-phenyl]ethyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[2-[4-benzyloxy-3-(methylcarbamothioylsulfamoyl)phenyl]ethyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[2-[3-[[methylamino(sulfanylidene)methyl]sulfamoyl]-4-phenylmethoxyphenyl]ethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-phenylmethoxyphenyl]ethyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[2-[4-benzoxy-3-(methylthiocarbamoylsulfamoyl)phenyl]ethyl]-3-(2-thienyl)acrylamide Formula: C24H25N3O4S3 MolecularWeight: 515.668

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCNC(=O)C=CC2=CC=CS2)OCC3=CC=CC=C3

Isomeric SMILES

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCNC(=O)/C=C/C2=CC=CS2)OCC3=CC=CC=C3

InChI

InChI=1S/C24H25N3O4S3/c1-25-24(32)27-34(29,30)22-16-18(9-11-21(22)31-17-19-6-3-2-4-7-19)13-14-26-23(28)12-10-20-8-5-15-33-20/h2-12,15-16H,13-14,17H2,1H3,(H,26,28)(H2,25,27,32)/b12-10+