N-(4-methylsulfanylphenyl)-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-(4-methylsulfanylphenyl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-(4-methylsulfanylphenyl)propanamide CAS Name: N-[4-(methylthio)phenyl]-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-(4-methylsulfanylphenyl)propanamide Traditional Name: 3-benzylsulfonyl-N-[4-(methylthio)phenyl]propionamide Formula: C17H19NO3S2 MolecularWeight: 349.46766

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C17H19NO3S2/c1-22-16-9-7-15(8-10-16)18-17(19)11-12-23(20,21)13-14-5-3-2-4-6-14/h2-10H,11-13H2,1H3,(H,18,19)