N-[1-(2,5-dimethylcyclohexyl)-2-oxidanyl-pentan-3-yl]-2-(methylsulfonylamino)-3-naphthalen-2-ylsulfanyl-propanamide

Systemtic Name: N-[1-(2,5-dimethylcyclohexyl)-2-oxidanyl-pentan-3-yl]-2-(methylsulfonylamino)-3-naphthalen-2-ylsulfanyl-propanamide Openeye Name: N-[3-(2,5-dimethylcyclohexyl)-1-ethyl-2-hydroxy-propyl]-2-(methanesulfonamido)-3-(2-naphthylsulfanyl)propanamide CAS Name: N-[1-(2,5-dimethylcyclohexyl)-2-hydroxypentan-3-yl]-2-(methanesulfonamido)-3-(2-naphthalenylthio)propanamide IUPAC Name: N-[1-(2,5-dimethylcyclohexyl)-2-hydroxypentan-3-yl]-2-(methanesulfonamido)-3-naphthalen-2-ylsulfanylpropanamide Traditional Name: N-[3-(2,5-dimethylcyclohexyl)-1-ethyl-2-hydroxy-propyl]-2-(methanesulfonamido)-3-(2-naphthylthio)propionamide Formula: C27H40N2O4S2 MolecularWeight: 520.7475

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC1CC(CCC1C)C)O)NC(=O)C(CSC2=CC3=CC=CC=C3C=C2)NS(=O)(=O)C

Isomeric SMILES

CCC(C(CC1CC(CCC1C)C)O)NC(=O)C(CSC2=CC3=CC=CC=C3C=C2)NS(=O)(=O)C

InChI

InChI=1S/C27H40N2O4S2/c1-5-24(26(30)16-22-14-18(2)10-11-19(22)3)28-27(31)25(29-35(4,32)33)17-34-23-13-12-20-8-6-7-9-21(20)15-23/h6-9,12-13,15,18-19,22,24-26,29-30H,5,10-11,14,16-17H2,1-4H3,(H,28,31)