ethyl 5-azanyl-4-cyano-3-[[2-(2-hydroxyethylamino)phenyl]carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[2-(2-hydroxyethylamino)phenyl]carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[2-(2-hydroxyethylamino)benzoyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[2-(2-hydroxyethylamino)phenyl]-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[2-(2-hydroxyethylamino)benzoyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[2-(2-hydroxyethylamino)benzoyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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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=C2NCCO

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=CC=C2NCCO

InChI

InChI=1S/C18H19N3O5S/c1-2-25-18(24)15-13(12(9-19)16(20)27-15)10-26-17(23)11-5-3-4-6-14(11)21-7-8-22/h3-6,21-22H,2,7-8,10,20H2,1H3