ethyl 5-azanyl-4-cyano-3-[2-(2-phenylethenylsulfonylamino)ethanoyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[2-(2-phenylethenylsulfonylamino)ethanoyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[2-(styrylsulfonylamino)acetyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[1-oxo-2-(2-phenylethenylsulfonylamino)ethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[2-(2-phenylethenylsulfonylamino)acetyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[2-(styrylsulfonylamino)acetyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C19H19N3O6S2 MolecularWeight: 449.50066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CNS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CNS(=O)(=O)C=CC2=CC=CC=C2

InChI

InChI=1S/C19H19N3O6S2/c1-2-27-19(24)17-15(14(10-20)18(21)29-17)12-28-16(23)11-22-30(25,26)9-8-13-6-4-3-5-7-13/h3-9,22H,2,11-12,21H2,1H3