ethyl 5-azanyl-3-[[2-(4-chlorophenyl)carbonylphenyl]carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[[2-(4-chlorophenyl)carbonylphenyl]carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-3-[[2-(4-chlorobenzoyl)benzoyl]oxymethyl]-4-cyano-thiophene-2-carboxylate CAS Name: 5-amino-3-[[[2-[(4-chlorophenyl)-oxomethyl]phenyl]-oxomethoxy]methyl]-4-cyano-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[[2-(4-chlorobenzoyl)benzoyl]oxymethyl]-4-cyanothiophene-2-carboxylate Traditional Name: 5-amino-3-[[2-(4-chlorobenzoyl)benzoyl]oxymethyl]-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C23H17ClN2O5S MolecularWeight: 468.90948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=CC=C2C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=CC=C2C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H17ClN2O5S/c1-2-30-23(29)20-18(17(11-25)21(26)32-20)12-31-22(28)16-6-4-3-5-15(16)19(27)13-7-9-14(24)10-8-13/h3-10H,2,12,26H2,1H3