ethyl 5-azanyl-3-(2-benzamidopropanoyloxymethyl)-4-cyano-thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-3-(2-benzamidopropanoyloxymethyl)-4-cyano-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-3-(2-benzamidopropanoyloxymethyl)-4-cyano-thiophene-2-carboxylate CAS Name: 5-amino-3-[(2-benzamido-1-oxopropoxy)methyl]-4-cyano-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-(2-benzamidopropanoyloxymethyl)-4-cyanothiophene-2-carboxylate Traditional Name: 5-amino-3-(2-benzamidopropanoyloxymethyl)-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O5S/c1-3-26-19(25)15-14(13(9-20)16(21)28-15)10-27-18(24)11(2)22-17(23)12-7-5-4-6-8-12/h4-8,11H,3,10,21H2,1-2H3,(H,22,23)