ethyl 2-cyano-4-(phenylsulfonyl)-2-thiophen-2-yl-butanoate

Systemtic Name: ethyl 2-cyano-4-(phenylsulfonyl)-2-thiophen-2-yl-butanoate Openeye Name: ethyl 4-(benzenesulfonyl)-2-cyano-2-(2-thienyl)butanoate CAS Name: 4-(benzenesulfonyl)-2-cyano-2-thiophen-2-ylbutanoic acid ethyl ester IUPAC Name: ethyl 4-(benzenesulfonyl)-2-cyano-2-thiophen-2-ylbutanoate Traditional Name: 4-besyl-2-cyano-2-(2-thienyl)butyric acid ethyl ester Formula: C17H17NO4S2 MolecularWeight: 363.45118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCS(=O)(=O)C1=CC=CC=C1)(C#N)C2=CC=CS2

Isomeric SMILES

CCOC(=O)C(CCS(=O)(=O)C1=CC=CC=C1)(C#N)C2=CC=CS2

InChI

InChI=1S/C17H17NO4S2/c1-2-22-16(19)17(13-18,15-9-6-11-23-15)10-12-24(20,21)14-7-4-3-5-8-14/h3-9,11H,2,10,12H2,1H3