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

Systemtic Name: 2-azanyl-N-[8-cyclohexyl-6-ethylsulfonyl-2-methyl-4-morpholin-4-yl-1-naphthalen-1-yl-5,6-bis(oxidanyl)-3-oxidanylidene-octan-4-yl]-3-oxidanyl-propanamide Openeye Name: 2-amino-N-[5-cyclohexyl-3-ethylsulfonyl-2,3-dihydroxy-1-[2-methyl-3-(1-naphthyl)propanoyl]-1-morpholino-pentyl]-3-hydroxy-propanamide CAS Name: 2-amino-N-[8-cyclohexyl-6-ethylsulfonyl-5,6-dihydroxy-2-methyl-4-(4-morpholinyl)-1-(1-naphthalenyl)-3-oxooctan-4-yl]-3-hydroxypropanamide IUPAC Name: 2-amino-N-(8-cyclohexyl-6-ethylsulfonyl-5,6-dihydroxy-2-methyl-4-morpholin-4-yl-1-naphthalen-1-yl-3-oxooctan-4-yl)-3-hydroxypropanamide Traditional Name: 2-amino-N-[5-cyclohexyl-3-esyl-2,3-dihydroxy-1-[2-methyl-3-(1-naphthyl)propanoyl]-1-morpholino-pentyl]-3-hydroxy-propionamide Formula: C34H51N3O8S MolecularWeight: 661.84904

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C(CCC1CCCCC1)(C(C(C(=O)C(C)CC2=CC=CC3=CC=CC=C32)(NC(=O)C(CO)N)N4CCOCC4)O)O

Isomeric SMILES

CCS(=O)(=O)C(CCC1CCCCC1)(C(C(C(=O)C(C)CC2=CC=CC3=CC=CC=C32)(NC(=O)C(CO)N)N4CCOCC4)O)O

InChI

InChI=1S/C34H51N3O8S/c1-3-46(43,44)33(42,17-16-25-10-5-4-6-11-25)32(41)34(36-31(40)29(35)23-38,37-18-20-45-21-19-37)30(39)24(2)22-27-14-9-13-26-12-7-8-15-28(26)27/h7-9,12-15,24-25,29,32,38,41-42H,3-6,10-11,16-23,35H2,1-2H3,(H,36,40)