N-[4-azanyl-4-cyclohexyl-1-(1H-imidazol-5-yl)-9-methyl-6,8-bis(oxidanyl)-3-oxidanylidene-decan-2-yl]-2-(tert-butylsulfonylmethyl)-3-phenyl-propanamide

Systemtic Name: N-[4-azanyl-4-cyclohexyl-1-(1H-imidazol-5-yl)-9-methyl-6,8-bis(oxidanyl)-3-oxidanylidene-decan-2-yl]-2-(tert-butylsulfonylmethyl)-3-phenyl-propanamide Openeye Name: N-[3-amino-3-cyclohexyl-5,7-dihydroxy-1-(1H-imidazol-5-ylmethyl)-8-methyl-2-oxo-nonyl]-2-benzyl-3-tert-butylsulfonyl-propanamide CAS Name: N-[4-amino-4-cyclohexyl-6,8-dihydroxy-1-(1H-imidazol-5-yl)-9-methyl-3-oxodecan-2-yl]-2-(tert-butylsulfonylmethyl)-3-phenylpropanamide IUPAC Name: N-[4-amino-4-cyclohexyl-6,8-dihydroxy-1-(1H-imidazol-5-yl)-9-methyl-3-oxodecan-2-yl]-2-benzyl-3-tert-butylsulfonylpropanamide Traditional Name: N-[3-amino-3-cyclohexyl-5,7-dihydroxy-1-(1H-imidazol-5-ylmethyl)-2-keto-8-methyl-nonyl]-2-benzyl-3-tert-butylsulfonyl-propionamide Formula: C34H54N4O6S MolecularWeight: 646.88076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(CC(C1CCCCC1)(C(=O)C(CC2=CN=CN2)NC(=O)C(CC3=CC=CC=C3)CS(=O)(=O)C(C)(C)C)N)O)O

Isomeric SMILES

CC(C)C(CC(CC(C1CCCCC1)(C(=O)C(CC2=CN=CN2)NC(=O)C(CC3=CC=CC=C3)CS(=O)(=O)C(C)(C)C)N)O)O

InChI

InChI=1S/C34H54N4O6S/c1-23(2)30(40)18-28(39)19-34(35,26-14-10-7-11-15-26)31(41)29(17-27-20-36-22-37-27)38-32(42)25(16-24-12-8-6-9-13-24)21-45(43,44)33(3,4)5/h6,8-9,12-13,20,22-23,25-26,28-30,39-40H,7,10-11,14-19,21,35H2,1-5H3,(H,36,37)(H,38,42)