2-[(4-tert-butylsulfonyl-3-phenyl-butanoyl)amino]-N-[1,4-dicyclohexyl-3,4-bis(oxidanyl)butan-2-yl]hexanamide

Systemtic Name: 2-[(4-tert-butylsulfonyl-3-phenyl-butanoyl)amino]-N-[1,4-dicyclohexyl-3,4-bis(oxidanyl)butan-2-yl]hexanamide Openeye Name: 2-[(4-tert-butylsulfonyl-3-phenyl-butanoyl)amino]-N-[3-cyclohexyl-1-(cyclohexylmethyl)-2,3-dihydroxy-propyl]hexanamide CAS Name: 2-[(4-tert-butylsulfonyl-1-oxo-3-phenylbutyl)amino]-N-(1,4-dicyclohexyl-3,4-dihydroxybutan-2-yl)hexanamide IUPAC Name: 2-[(4-tert-butylsulfonyl-3-phenylbutanoyl)amino]-N-(1,4-dicyclohexyl-3,4-dihydroxybutan-2-yl)hexanamide Traditional Name: 2-[(4-tert-butylsulfonyl-3-phenyl-butanoyl)amino]-N-[3-cyclohexyl-1-(cyclohexylmethyl)-2,3-dihydroxy-propyl]hexanamide Formula: C36H60N2O6S MolecularWeight: 648.9364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(CC1CCCCC1)C(C(C2CCCCC2)O)O)NC(=O)CC(CS(=O)(=O)C(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CCCCC(C(=O)NC(CC1CCCCC1)C(C(C2CCCCC2)O)O)NC(=O)CC(CS(=O)(=O)C(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C36H60N2O6S/c1-5-6-22-30(37-32(39)24-29(27-18-12-8-13-19-27)25-45(43,44)36(2,3)4)35(42)38-31(23-26-16-10-7-11-17-26)34(41)33(40)28-20-14-9-15-21-28/h8,12-13,18-19,26,28-31,33-34,40-41H,5-7,9-11,14-17,20-25H2,1-4H3,(H,37,39)(H,38,42)