3-methylsulfanyl-N-[1-(4-methylsulfonylphenyl)ethyl]propanamide

Systemtic Name: 3-methylsulfanyl-N-[1-(4-methylsulfonylphenyl)ethyl]propanamide Openeye Name: 3-methylsulfanyl-N-[1-(4-methylsulfonylphenyl)ethyl]propanamide CAS Name: N-[1-(4-methylsulfonylphenyl)ethyl]-3-(methylthio)propanamide IUPAC Name: 3-methylsulfanyl-N-[1-(4-methylsulfonylphenyl)ethyl]propanamide Traditional Name: N-[1-(4-mesylphenyl)ethyl]-3-(methylthio)propionamide Formula: C13H19NO3S2 MolecularWeight: 301.42486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)CCSC

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)CCSC

InChI

InChI=1S/C13H19NO3S2/c1-10(14-13(15)8-9-18-2)11-4-6-12(7-5-11)19(3,16)17/h4-7,10H,8-9H2,1-3H3,(H,14,15)