ethyl 5-azanyl-4-cyano-3-[2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethanoyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethanoyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[2-[(3,4,5-trimethoxybenzoyl)amino]acetyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[1-oxo-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]ethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[2-[(3,4,5-trimethoxybenzoyl)amino]acetyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[2-[(3,4,5-trimethoxybenzoyl)amino]acetyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C21H23N3O8S MolecularWeight: 477.48762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C21H23N3O8S/c1-5-31-21(27)18-13(12(8-22)19(23)33-18)10-32-16(25)9-24-20(26)11-6-14(28-2)17(30-4)15(7-11)29-3/h6-7H,5,9-10,23H2,1-4H3,(H,24,26)