3-tert-butyl-N-(methylsulfanylmethyl)-4-oxidanyl-benzamide

Systemtic Name: 3-tert-butyl-N-(methylsulfanylmethyl)-4-oxidanyl-benzamide Openeye Name: 3-tert-butyl-4-hydroxy-N-(methylsulfanylmethyl)benzamide CAS Name: 3-tert-butyl-4-hydroxy-N-[(methylthio)methyl]benzamide IUPAC Name: 3-tert-butyl-4-hydroxy-N-(methylsulfanylmethyl)benzamide Traditional Name: 3-tert-butyl-4-hydroxy-N-[(methylthio)methyl]benzamide Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C(=O)NCSC)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C(=O)NCSC)O

InChI

InChI=1S/C13H19NO2S/c1-13(2,3)10-7-9(5-6-11(10)15)12(16)14-8-17-4/h5-7,15H,8H2,1-4H3,(H,14,16)