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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[2-(4-cyanophenoxy)ethanoyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[2-(4-cyanophenoxy)acetyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[2-(4-cyanophenoxy)-1-oxoethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[2-(4-cyanophenoxy)acetyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[2-(4-cyanophenoxy)acetyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)COC2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)COC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H15N3O5S/c1-2-24-18(23)16-14(13(8-20)17(21)27-16)9-26-15(22)10-25-12-5-3-11(7-19)4-6-12/h3-6H,2,9-10,21H2,1H3