3-[2-[(4-chlorophenyl)methylsulfanyl]ethylsulfonyl]propanamide

Systemtic Name: 3-[2-[(4-chlorophenyl)methylsulfanyl]ethylsulfonyl]propanamide Openeye Name: 3-[2-[(4-chlorophenyl)methylsulfanyl]ethylsulfonyl]propanamide CAS Name: 3-[2-[(4-chlorophenyl)methylthio]ethylsulfonyl]propanamide IUPAC Name: 3-[2-[(4-chlorophenyl)methylsulfanyl]ethylsulfonyl]propanamide Traditional Name: 3-[2-[(4-chlorobenzyl)thio]ethylsulfonyl]propionamide Formula: C12H16ClNO3S2 MolecularWeight: 321.84334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCCS(=O)(=O)CCC(=O)N)Cl

Isomeric SMILES

C1=CC(=CC=C1CSCCS(=O)(=O)CCC(=O)N)Cl

InChI

InChI=1S/C12H16ClNO3S2/c13-11-3-1-10(2-4-11)9-18-6-8-19(16,17)7-5-12(14)15/h1-4H,5-9H2,(H2,14,15)