2-azanyl-N-[8-cyclohexyl-4-morpholin-4-yl-5,6-bis(oxidanyl)-3-oxidanylidene-5-(phenylmethyl)-1-pyrimidin-2-ylsulfonyl-octan-4-yl]hexanamide

Systemtic Name: 2-azanyl-N-[8-cyclohexyl-4-morpholin-4-yl-5,6-bis(oxidanyl)-3-oxidanylidene-5-(phenylmethyl)-1-pyrimidin-2-ylsulfonyl-octan-4-yl]hexanamide Openeye Name: 2-amino-N-[2-benzyl-5-cyclohexyl-2,3-dihydroxy-1-morpholino-1-(3-pyrimidin-2-ylsulfonylpropanoyl)pentyl]hexanamide CAS Name: 2-amino-N-[8-cyclohexyl-5,6-dihydroxy-4-(4-morpholinyl)-3-oxo-5-(phenylmethyl)-1-(2-pyrimidinylsulfonyl)octan-4-yl]hexanamide IUPAC Name: 2-amino-N-(5-benzyl-8-cyclohexyl-5,6-dihydroxy-4-morpholin-4-yl-3-oxo-1-pyrimidin-2-ylsulfonyloctan-4-yl)hexanamide Traditional Name: 2-amino-N-[2-benzyl-5-cyclohexyl-2,3-dihydroxy-1-morpholino-1-[3-(2-pyrimidylsulfonyl)propanoyl]pentyl]hexanamide Formula: C35H53N5O7S MolecularWeight: 687.88962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(C(=O)CCS(=O)(=O)C1=NC=CC=N1)(C(CC2=CC=CC=C2)(C(CCC3CCCCC3)O)O)N4CCOCC4)N

Isomeric SMILES

CCCCC(C(=O)NC(C(=O)CCS(=O)(=O)C1=NC=CC=N1)(C(CC2=CC=CC=C2)(C(CCC3CCCCC3)O)O)N4CCOCC4)N

InChI

InChI=1S/C35H53N5O7S/c1-2-3-15-29(36)32(43)39-35(40-21-23-47-24-22-40,31(42)18-25-48(45,46)33-37-19-10-20-38-33)34(44,26-28-13-8-5-9-14-28)30(41)17-16-27-11-6-4-7-12-27/h5,8-10,13-14,19-20,27,29-30,41,44H,2-4,6-7,11-12,15-18,21-26,36H2,1H3,(H,39,43)