ethyl 2-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[3-(dimethylsulfamoyl)anilino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(dimethylsulfamoyl)phenyl]carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[3-(dimethylsulfamoyl)phenyl]thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H23N3O4S3 MolecularWeight: 441.58792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=S)NC2=CC(=CC=C2)S(=O)(=O)N(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=S)NC2=CC(=CC=C2)S(=O)(=O)N(C)C

InChI

InChI=1S/C18H23N3O4S3/c1-6-25-17(22)15-11(2)12(3)27-16(15)20-18(26)19-13-8-7-9-14(10-13)28(23,24)21(4)5/h7-10H,6H2,1-5H3,(H2,19,20,26)