ethyl 2-[[4-(ethylsulfamoyl)phenyl]carbamothioylamino]-5-(phenylmethyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-(ethylsulfamoyl)phenyl]carbamothioylamino]-5-(phenylmethyl)thiophene-3-carboxylate Openeye Name: ethyl 5-benzyl-2-[[4-(ethylsulfamoyl)phenyl]carbamothioylamino]thiophene-3-carboxylate CAS Name: 2-[[[4-(ethylsulfamoyl)anilino]-sulfanylidenemethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzyl-2-[[4-(ethylsulfamoyl)phenyl]carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-benzyl-2-[[4-(ethylsulfamoyl)phenyl]thiocarbamoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C23H25N3O4S3 MolecularWeight: 503.6573

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Descriptors Computed from Structure

Canonical SMILES:

CCNS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C=C(S2)CC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCNS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC2=C(C=C(S2)CC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C23H25N3O4S3/c1-3-24-33(28,29)19-12-10-17(11-13-19)25-23(31)26-21-20(22(27)30-4-2)15-18(32-21)14-16-8-6-5-7-9-16/h5-13,15,24H,3-4,14H2,1-2H3,(H2,25,26,31)