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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[2-(3,4-dichlorophenyl)ethanoyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[2-(3,4-dichlorophenyl)acetyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[2-(3,4-dichlorophenyl)-1-oxoethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[2-(3,4-dichlorophenyl)acetyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[2-(3,4-dichlorophenyl)acetyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C17H14Cl2N2O4S MolecularWeight: 413.27506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H14Cl2N2O4S/c1-2-24-17(23)15-11(10(7-20)16(21)26-15)8-25-14(22)6-9-3-4-12(18)13(19)5-9/h3-5H,2,6,8,21H2,1H3