ethyl 5-azanyl-4-cyano-3-[[2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[2-[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl]sulfanylphenyl]carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[2-[2-(2-methoxyethylamino)-2-oxo-ethyl]sulfanylbenzoyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[2-[[2-(2-methoxyethylamino)-2-oxoethyl]thio]phenyl]-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[2-[2-(2-methoxyethylamino)-2-oxoethyl]sulfanylbenzoyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[2-[[2-keto-2-(2-methoxyethylamino)ethyl]thio]benzoyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C21H23N3O6S2 MolecularWeight: 477.55382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=CC=C2SCC(=O)NCCOC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=CC=C2SCC(=O)NCCOC

InChI

InChI=1S/C21H23N3O6S2/c1-3-29-21(27)18-15(14(10-22)19(23)32-18)11-30-20(26)13-6-4-5-7-16(13)31-12-17(25)24-8-9-28-2/h4-7H,3,8-9,11-12,23H2,1-2H3,(H,24,25)