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

Systemtic Name: 2-azanyl-N-[8-cyclohexyl-2-methyl-4-methylsulfanyl-1-naphthalen-1-yl-5,6-bis(oxidanyl)-3-oxidanylidene-octan-4-yl]hexanamide Openeye Name: 2-amino-N-[5-cyclohexyl-2,3-dihydroxy-1-[2-methyl-3-(1-naphthyl)propanoyl]-1-methylsulfanyl-pentyl]hexanamide CAS Name: 2-amino-N-[8-cyclohexyl-5,6-dihydroxy-2-methyl-4-(methylthio)-1-(1-naphthalenyl)-3-oxooctan-4-yl]hexanamide IUPAC Name: 2-amino-N-(8-cyclohexyl-5,6-dihydroxy-2-methyl-4-methylsulfanyl-1-naphthalen-1-yl-3-oxooctan-4-yl)hexanamide Traditional Name: 2-amino-N-[5-cyclohexyl-2,3-dihydroxy-1-[2-methyl-3-(1-naphthyl)propanoyl]-1-(methylthio)pentyl]hexanamide Formula: C32H48N2O4S MolecularWeight: 556.79952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(C(C(CCC1CCCCC1)O)O)(C(=O)C(C)CC2=CC=CC3=CC=CC=C32)SC)N

Isomeric SMILES

CCCCC(C(=O)NC(C(C(CCC1CCCCC1)O)O)(C(=O)C(C)CC2=CC=CC3=CC=CC=C32)SC)N

InChI

InChI=1S/C32H48N2O4S/c1-4-5-18-27(33)31(38)34-32(39-3,30(37)28(35)20-19-23-12-7-6-8-13-23)29(36)22(2)21-25-16-11-15-24-14-9-10-17-26(24)25/h9-11,14-17,22-23,27-28,30,35,37H,4-8,12-13,18-21,33H2,1-3H3,(H,34,38)