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

Systemtic Name: methyl 2-[[4-(tert-butylsulfamoyl)phenyl]carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[4-(tert-butylsulfamoyl)phenyl]carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[4-(tert-butylsulfamoyl)anilino]-sulfanylidenemethyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(tert-butylsulfamoyl)phenyl]carbamothioylamino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[4-(tert-butylsulfamoyl)phenyl]thiocarbamoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C24H27N3O4S3 MolecularWeight: 517.68388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3O4S3/c1-15-19(16-9-7-6-8-10-16)20(22(28)31-5)21(33-15)26-23(32)25-17-11-13-18(14-12-17)34(29,30)27-24(2,3)4/h6-14,27H,1-5H3,(H2,25,26,32)