2-azanyl-N-[8-cyclohexyl-5-(furan-3-ylmethylsulfonyl)-2-methyl-4-morpholin-4-yl-1-naphthalen-1-yl-5,6-bis(oxidanyl)-3-oxidanylidene-octan-4-yl]hexanamide

Systemtic Name: 2-azanyl-N-[8-cyclohexyl-5-(furan-3-ylmethylsulfonyl)-2-methyl-4-morpholin-4-yl-1-naphthalen-1-yl-5,6-bis(oxidanyl)-3-oxidanylidene-octan-4-yl]hexanamide Openeye Name: 2-amino-N-[5-cyclohexyl-2-(3-furylmethylsulfonyl)-2,3-dihydroxy-1-[2-methyl-3-(1-naphthyl)propanoyl]-1-morpholino-pentyl]hexanamide CAS Name: 2-amino-N-[8-cyclohexyl-5-(3-furanylmethylsulfonyl)-5,6-dihydroxy-2-methyl-4-(4-morpholinyl)-1-(1-naphthalenyl)-3-oxooctan-4-yl]hexanamide IUPAC Name: 2-amino-N-[8-cyclohexyl-5-(furan-3-ylmethylsulfonyl)-5,6-dihydroxy-2-methyl-4-morpholin-4-yl-1-naphthalen-1-yl-3-oxooctan-4-yl]hexanamide Traditional Name: 2-amino-N-[5-cyclohexyl-2-(3-furfurylsulfonyl)-2,3-dihydroxy-1-[2-methyl-3-(1-naphthyl)propanoyl]-1-morpholino-pentyl]hexanamide Formula: C40H57N3O8S MolecularWeight: 739.96088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(C(=O)C(C)CC1=CC=CC2=CC=CC=C21)(C(C(CCC3CCCCC3)O)(O)S(=O)(=O)CC4=COC=C4)N5CCOCC5)N

Isomeric SMILES

CCCCC(C(=O)NC(C(=O)C(C)CC1=CC=CC2=CC=CC=C21)(C(C(CCC3CCCCC3)O)(O)S(=O)(=O)CC4=COC=C4)N5CCOCC5)N

InChI

InChI=1S/C40H57N3O8S/c1-3-4-17-35(41)38(46)42-39(43-21-24-50-25-22-43,37(45)29(2)26-33-15-10-14-32-13-8-9-16-34(32)33)40(47,52(48,49)28-31-20-23-51-27-31)36(44)19-18-30-11-6-5-7-12-30/h8-10,13-16,20,23,27,29-30,35-36,44,47H,3-7,11-12,17-19,21-22,24-26,28,41H2,1-2H3,(H,42,46)