N-(3-chloranyl-4-cyano-phenyl)-2-(2-oxidanylpropylsulfanyl)propanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-(2-oxidanylpropylsulfanyl)propanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-(2-hydroxypropylsulfanyl)propanamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-(2-hydroxypropylthio)propanamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-(2-hydroxypropylsulfanyl)propanamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-(2-hydroxypropylthio)propionamide Formula: C13H15ClN2O2S MolecularWeight: 298.7884

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(C)C(=O)NC1=CC(=C(C=C1)C#N)Cl)O

Isomeric SMILES

CC(CSC(C)C(=O)NC1=CC(=C(C=C1)C#N)Cl)O

InChI

InChI=1S/C13H15ClN2O2S/c1-8(17)7-19-9(2)13(18)16-11-4-3-10(6-15)12(14)5-11/h3-5,8-9,17H,7H2,1-2H3,(H,16,18)