N-(2-chloranyl-5-methylsulfonyl-phenyl)-3-methylsulfanyl-propanamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-3-methylsulfanyl-propanamide Openeye Name: N-(2-chloro-5-methylsulfonyl-phenyl)-3-methylsulfanyl-propanamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-3-(methylthio)propanamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-3-methylsulfanylpropanamide Traditional Name: N-(2-chloro-5-mesyl-phenyl)-3-(methylthio)propionamide Formula: C11H14ClNO3S2 MolecularWeight: 307.81676

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)C)Cl

Isomeric SMILES

CSCCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)C)Cl

InChI

InChI=1S/C11H14ClNO3S2/c1-17-6-5-11(14)13-10-7-8(18(2,15)16)3-4-9(10)12/h3-4,7H,5-6H2,1-2H3,(H,13,14)