ethyl 5-phenyl-2-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-phenyl-2-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]carbamothioylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-phenyl-2-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-phenyl-2-[[sulfanylidene-[4-[(2,4,6-trimethylphenyl)sulfamoyl]anilino]methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-2-[[4-[(2,4,6-trimethylphenyl)sulfamoyl]phenyl]carbamothioylamino]thiophene-3-carboxylate Traditional Name: 2-[[4-(mesitylsulfamoyl)phenyl]thiocarbamoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C29H29N3O4S3 MolecularWeight: 579.75326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=C(C=C(C=C4C)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NC4=C(C=C(C=C4C)C)C

InChI

InChI=1S/C29H29N3O4S3/c1-5-36-28(33)24-17-25(21-9-7-6-8-10-21)38-27(24)31-29(37)30-22-11-13-23(14-12-22)39(34,35)32-26-19(3)15-18(2)16-20(26)4/h6-17,32H,5H2,1-4H3,(H2,30,31,37)