methyl 2-[[4-(tert-butylsulfamoyl)phenyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[4-(tert-butylsulfamoyl)phenyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[4-(tert-butylsulfamoyl)phenyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[[4-(tert-butylsulfamoyl)anilino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(tert-butylsulfamoyl)phenyl]carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[4-(tert-butylsulfamoyl)phenyl]thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C19H25N3O4S3 MolecularWeight: 455.6145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)C

InChI

InChI=1S/C19H25N3O4S3/c1-11-12(2)28-16(15(11)17(23)26-6)21-18(27)20-13-7-9-14(10-8-13)29(24,25)22-19(3,4)5/h7-10,22H,1-6H3,(H2,20,21,27)