ethyl 2-(methylsulfonylaminocarbamothioylamino)-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(methylsulfonylaminocarbamothioylamino)-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(methanesulfonamidocarbamothioylamino)-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(methylsulfonylhydrazo)-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(methanesulfonamidocarbamothioylamino)-5-phenylthiophene-3-carboxylate Traditional Name: 2-(methanesulfonamidothiocarbamoylamino)-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C15H17N3O4S3 MolecularWeight: 399.50818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NNS(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NNS(=O)(=O)C

InChI

InChI=1S/C15H17N3O4S3/c1-3-22-14(19)11-9-12(10-7-5-4-6-8-10)24-13(11)16-15(23)17-18-25(2,20)21/h4-9,18H,3H2,1-2H3,(H2,16,17,23)