N-[1-(2-ethanoyl-4-methyl-cyclohexyl)-2-oxidanyl-pentan-3-yl]-2-(methylsulfonylamino)-3-naphthalen-2-ylsulfanyl-propanamide

Systemtic Name: N-[1-(2-ethanoyl-4-methyl-cyclohexyl)-2-oxidanyl-pentan-3-yl]-2-(methylsulfonylamino)-3-naphthalen-2-ylsulfanyl-propanamide Openeye Name: N-[3-(2-acetyl-4-methyl-cyclohexyl)-1-ethyl-2-hydroxy-propyl]-2-(methanesulfonamido)-3-(2-naphthylsulfanyl)propanamide CAS Name: N-[1-(2-acetyl-4-methylcyclohexyl)-2-hydroxypentan-3-yl]-2-(methanesulfonamido)-3-(2-naphthalenylthio)propanamide IUPAC Name: N-[1-(2-acetyl-4-methylcyclohexyl)-2-hydroxypentan-3-yl]-2-(methanesulfonamido)-3-naphthalen-2-ylsulfanylpropanamide Traditional Name: N-[3-(2-acetyl-4-methyl-cyclohexyl)-1-ethyl-2-hydroxy-propyl]-2-(methanesulfonamido)-3-(2-naphthylthio)propionamide Formula: C28H40N2O5S2 MolecularWeight: 548.7576

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC1CCC(CC1C(=O)C)C)O)NC(=O)C(CSC2=CC3=CC=CC=C3C=C2)NS(=O)(=O)C

Isomeric SMILES

CCC(C(CC1CCC(CC1C(=O)C)C)O)NC(=O)C(CSC2=CC3=CC=CC=C3C=C2)NS(=O)(=O)C

InChI

InChI=1S/C28H40N2O5S2/c1-5-25(27(32)16-22-11-10-18(2)14-24(22)19(3)31)29-28(33)26(30-37(4,34)35)17-36-23-13-12-20-8-6-7-9-21(20)15-23/h6-9,12-13,15,18,22,24-27,30,32H,5,10-11,14,16-17H2,1-4H3,(H,29,33)