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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[2-[(4-ethoxyphenyl)carbonylamino]ethanoyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[2-[(4-ethoxybenzoyl)amino]acetyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[2-[[(4-ethoxyphenyl)-oxomethyl]amino]-1-oxoethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[2-[(4-ethoxybenzoyl)amino]acetyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[2-[(4-ethoxybenzoyl)amino]acetyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=C(SC(=C2C#N)N)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=C(SC(=C2C#N)N)C(=O)OCC

InChI

InChI=1S/C20H21N3O6S/c1-3-27-13-7-5-12(6-8-13)19(25)23-10-16(24)29-11-15-14(9-21)18(22)30-17(15)20(26)28-4-2/h5-8H,3-4,10-11,22H2,1-2H3,(H,23,25)