ethyl 5-azanyl-3-[[1-(4-chlorophenyl)cyclobutyl]carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[[1-(4-chlorophenyl)cyclobutyl]carbonyloxymethyl]-4-cyano-thiophene-2-carboxylate Openeye Name: ethyl 5-amino-3-[[1-(4-chlorophenyl)cyclobutanecarbonyl]oxymethyl]-4-cyano-thiophene-2-carboxylate CAS Name: 5-amino-3-[[[1-(4-chlorophenyl)cyclobutyl]-oxomethoxy]methyl]-4-cyano-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[[1-(4-chlorophenyl)cyclobutanecarbonyl]oxymethyl]-4-cyanothiophene-2-carboxylate Traditional Name: 5-amino-3-[[1-(4-chlorophenyl)cyclobutanecarbonyl]oxymethyl]-4-cyano-thiophene-2-carboxylic acid ethyl ester Formula: C20H19ClN2O4S MolecularWeight: 418.89386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2(CCC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2(CCC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O4S/c1-2-26-18(24)16-15(14(10-22)17(23)28-16)11-27-19(25)20(8-3-9-20)12-4-6-13(21)7-5-12/h4-7H,2-3,8-9,11,23H2,1H3