2-[(4-methyl-4-nitrososulfanyl-cyclohexyl)amino]-1-(1,1,3,3-tetramethyl-2-oxidanyl-isoindol-5-yl)ethanol

Systemtic Name: 2-[(4-methyl-4-nitrososulfanyl-cyclohexyl)amino]-1-(1,1,3,3-tetramethyl-2-oxidanyl-isoindol-5-yl)ethanol Openeye Name: 1-(2-hydroxy-1,1,3,3-tetramethyl-isoindolin-5-yl)-2-[(4-methyl-4-nitrososulfanyl-cyclohexyl)amino]ethanol CAS Name: 4-[[2-hydroxy-2-(2-hydroxy-1,1,3,3-tetramethyl-5-isoindolyl)ethyl]amino]-1-methyl-N-oxo-1-cyclohexanesulfenamide IUPAC Name: 1-(2-hydroxy-1,1,3,3-tetramethylisoindol-5-yl)-2-[(4-methyl-4-nitrososulfanylcyclohexyl)amino]ethanol Traditional Name: 1-(2-hydroxy-1,1,3,3-tetramethyl-isoindolin-5-yl)-2-[[4-methyl-4-(nitrosothio)cyclohexyl]amino]ethanol Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=C(C=C2)C(CNC3CCC(CC3)(C)SN=O)O)C(N1O)(C)C)C

Isomeric SMILES

CC1(C2=C(C=C(C=C2)C(CNC3CCC(CC3)(C)SN=O)O)C(N1O)(C)C)C

InChI

InChI=1S/C21H33N3O3S/c1-19(2)16-7-6-14(12-17(16)20(3,4)24(19)27)18(25)13-22-15-8-10-21(5,11-9-15)28-23-26/h6-7,12,15,18,22,25,27H,8-11,13H2,1-5H3