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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-(3-thiophen-3-ylpropanoyloxymethyl)thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[3-(3-thienyl)propanoyloxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[1-oxo-3-(3-thiophenyl)propoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-(3-thiophen-3-ylpropanoyloxymethyl)thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[3-(3-thienyl)propanoyloxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C16H16N2O4S2 MolecularWeight: 364.43924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CCC2=CSC=C2

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CCC2=CSC=C2

InChI

InChI=1S/C16H16N2O4S2/c1-2-21-16(20)14-12(11(7-17)15(18)24-14)8-22-13(19)4-3-10-5-6-23-9-10/h5-6,9H,2-4,8,18H2,1H3