2-azanyl-N-[8-cyclohexyl-2-methyl-4-morpholin-4-yl-5,6-bis(oxidanyl)-3-oxidanylidene-1-phenyl-7-sulfonyl-octan-4-yl]hexanamide

Systemtic Name: 2-azanyl-N-[8-cyclohexyl-2-methyl-4-morpholin-4-yl-5,6-bis(oxidanyl)-3-oxidanylidene-1-phenyl-7-sulfonyl-octan-4-yl]hexanamide Openeye Name: 2-amino-N-[5-cyclohexyl-2,3-dihydroxy-1-(2-methyl-3-phenyl-propanoyl)-1-morpholino-4-sulfonyl-pentyl]hexanamide CAS Name: 2-amino-N-[8-cyclohexyl-5,6-dihydroxy-2-methyl-4-(4-morpholinyl)-3-oxo-1-phenyl-7-sulfonyloctan-4-yl]hexanamide IUPAC Name: 2-amino-N-(8-cyclohexyl-5,6-dihydroxy-2-methyl-4-morpholin-4-yl-3-oxo-1-phenyl-7-sulfonyloctan-4-yl)hexanamide Traditional Name: 2-amino-N-[5-cyclohexyl-2,3-dihydroxy-1-(2-methyl-3-phenyl-propanoyl)-1-morpholino-4-sulfonyl-pentyl]hexanamide Formula: C31H49N3O7S MolecularWeight: 607.80166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(C(C(C(=S(=O)=O)CC1CCCCC1)O)O)(C(=O)C(C)CC2=CC=CC=C2)N3CCOCC3)N

Isomeric SMILES

CCCCC(C(=O)NC(C(C(C(=S(=O)=O)CC1CCCCC1)O)O)(C(=O)C(C)CC2=CC=CC=C2)N3CCOCC3)N

InChI

InChI=1S/C31H49N3O7S/c1-3-4-15-25(32)30(38)33-31(34-16-18-41-19-17-34,28(36)22(2)20-23-11-7-5-8-12-23)29(37)27(35)26(42(39)40)21-24-13-9-6-10-14-24/h5,7-8,11-12,22,24-25,27,29,35,37H,3-4,6,9-10,13-21,32H2,1-2H3,(H,33,38)