2-(3-chloranyl-4-fluoranyl-phenyl)sulfanyl-N-(2-cyanoethyl)-N-phenyl-ethanamide

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenyl)sulfanyl-N-(2-cyanoethyl)-N-phenyl-ethanamide Openeye Name: 2-(3-chloro-4-fluoro-phenyl)sulfanyl-N-(2-cyanoethyl)-N-phenyl-acetamide CAS Name: 2-[(3-chloro-4-fluorophenyl)thio]-N-(2-cyanoethyl)-N-phenylacetamide IUPAC Name: 2-(3-chloro-4-fluorophenyl)sulfanyl-N-(2-cyanoethyl)-N-phenylacetamide Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)thio]-N-(2-cyanoethyl)-N-phenyl-acetamide Formula: C17H14ClFN2OS MolecularWeight: 348.822263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C17H14ClFN2OS/c18-15-11-14(7-8-16(15)19)23-12-17(22)21(10-4-9-20)13-5-2-1-3-6-13/h1-3,5-8,11H,4,10,12H2