2-(tert-butylsulfonylmethyl)-N-(2-oxidanylideneethylsulfanylmethyl)-3-phenyl-propanamide

Systemtic Name: 2-(tert-butylsulfonylmethyl)-N-(2-oxidanylideneethylsulfanylmethyl)-3-phenyl-propanamide Openeye Name: 2-benzyl-3-tert-butylsulfonyl-N-(2-oxoethylsulfanylmethyl)propanamide CAS Name: 2-(tert-butylsulfonylmethyl)-N-[(2-oxoethylthio)methyl]-3-phenylpropanamide IUPAC Name: 2-benzyl-3-tert-butylsulfonyl-N-(2-oxoethylsulfanylmethyl)propanamide Traditional Name: 2-benzyl-3-tert-butylsulfonyl-N-[(2-ketoethylthio)methyl]propionamide Formula: C17H25NO4S2 MolecularWeight: 371.5147

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)CC(CC1=CC=CC=C1)C(=O)NCSCC=O

Isomeric SMILES

CC(C)(C)S(=O)(=O)CC(CC1=CC=CC=C1)C(=O)NCSCC=O

InChI

InChI=1S/C17H25NO4S2/c1-17(2,3)24(21,22)12-15(11-14-7-5-4-6-8-14)16(20)18-13-23-10-9-19/h4-9,15H,10-13H2,1-3H3,(H,18,20)