2-[3-(methylcarbamothioylsulfamoyl)-4-propoxy-phenyl]-N-(1-thiophen-2-ylpropyl)ethanamide

Systemtic Name: 2-[3-(methylcarbamothioylsulfamoyl)-4-propoxy-phenyl]-N-(1-thiophen-2-ylpropyl)ethanamide Openeye Name: 2-[3-(methylcarbamothioylsulfamoyl)-4-propoxy-phenyl]-N-[1-(2-thienyl)propyl]acetamide CAS Name: 2-[3-[[methylamino(sulfanylidene)methyl]sulfamoyl]-4-propoxyphenyl]-N-(1-thiophen-2-ylpropyl)acetamide IUPAC Name: 2-[3-(methylcarbamothioylsulfamoyl)-4-propoxyphenyl]-N-(1-thiophen-2-ylpropyl)acetamide Traditional Name: 2-[3-(methylthiocarbamoylsulfamoyl)-4-propoxy-phenyl]-N-[1-(2-thienyl)propyl]acetamide Formula: C20H27N3O4S3 MolecularWeight: 469.64108

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CC(=O)NC(CC)C2=CC=CS2)S(=O)(=O)NC(=S)NC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CC(=O)NC(CC)C2=CC=CS2)S(=O)(=O)NC(=S)NC

InChI

InChI=1S/C20H27N3O4S3/c1-4-10-27-16-9-8-14(12-18(16)30(25,26)23-20(28)21-3)13-19(24)22-15(5-2)17-7-6-11-29-17/h6-9,11-12,15H,4-5,10,13H2,1-3H3,(H,22,24)(H2,21,23,28)