N-[1-[(7-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-4-methylsulfanyl-butan-2-yl]-N-oxidanyl-methanamide

Systemtic Name: N-[1-[(7-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-4-methylsulfanyl-butan-2-yl]-N-oxidanyl-methanamide Openeye Name: N-[1-[(7-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonylmethyl]-3-methylsulfanyl-propyl]-N-hydroxy-formamide CAS Name: N-[1-[(7-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-4-(methylthio)butan-2-yl]-N-hydroxyformamide IUPAC Name: N-[1-[(7-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]-4-methylsulfanylbutan-2-yl]-N-hydroxyformamide Traditional Name: N-[1-[(7-tert-butyl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonylmethyl]-3-(methylthio)propyl]-N-hydroxy-formamide Formula: C19H30N2O4S2 MolecularWeight: 414.5825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(CCN(C2)S(=O)(=O)CC(CCSC)N(C=O)O)C=C1

Isomeric SMILES

CC(C)(C)C1=CC2=C(CCN(C2)S(=O)(=O)CC(CCSC)N(C=O)O)C=C1

InChI

InChI=1S/C19H30N2O4S2/c1-19(2,3)17-6-5-15-7-9-20(12-16(15)11-17)27(24,25)13-18(8-10-26-4)21(23)14-22/h5-6,11,14,18,23H,7-10,12-13H2,1-4H3