N-(2-cyanoethyl)-3-(4-fluorophenyl)sulfanyl-N-methyl-propanamide

Systemtic Name: N-(2-cyanoethyl)-3-(4-fluorophenyl)sulfanyl-N-methyl-propanamide Openeye Name: N-(2-cyanoethyl)-3-(4-fluorophenyl)sulfanyl-N-methyl-propanamide CAS Name: N-(2-cyanoethyl)-3-[(4-fluorophenyl)thio]-N-methylpropanamide IUPAC Name: N-(2-cyanoethyl)-3-(4-fluorophenyl)sulfanyl-N-methylpropanamide Traditional Name: N-(2-cyanoethyl)-3-[(4-fluorophenyl)thio]-N-methyl-propionamide Formula: C13H15FN2OS MolecularWeight: 266.334403

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CCSC1=CC=C(C=C1)F

Isomeric SMILES

CN(CCC#N)C(=O)CCSC1=CC=C(C=C1)F

InChI

InChI=1S/C13H15FN2OS/c1-16(9-2-8-15)13(17)7-10-18-12-5-3-11(14)4-6-12/h3-6H,2,7,9-10H2,1H3