6-cyclohexyl-N-methyl-4-oxidanyl-2-(3-oxidanylpentan-3-yl)-N-propanoyl-3-[2-(1,3-thiazol-4-ylamino)propanoylamino]hexanamide

Systemtic Name: 6-cyclohexyl-N-methyl-4-oxidanyl-2-(3-oxidanylpentan-3-yl)-N-propanoyl-3-[2-(1,3-thiazol-4-ylamino)propanoylamino]hexanamide Openeye Name: 6-cyclohexyl-2-(1-ethyl-1-hydroxy-propyl)-4-hydroxy-N-methyl-N-propanoyl-3-[2-(thiazol-4-ylamino)propanoylamino]hexanamide CAS Name: 6-cyclohexyl-4-hydroxy-2-(3-hydroxypentan-3-yl)-N-methyl-N-(1-oxopropyl)-3-[[1-oxo-2-(4-thiazolylamino)propyl]amino]hexanamide IUPAC Name: 6-cyclohexyl-4-hydroxy-2-(3-hydroxypentan-3-yl)-N-methyl-N-propanoyl-3-[2-(1,3-thiazol-4-ylamino)propanoylamino]hexanamide Traditional Name: 6-cyclohexyl-2-(1-ethyl-1-hydroxy-propyl)-4-hydroxy-N-methyl-N-propionyl-3-[2-(thiazol-4-ylamino)propanoylamino]hexanamide Formula: C27H46N4O5S MolecularWeight: 538.74294

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C)C(=O)C(C(C(CCC1CCCCC1)O)NC(=O)C(C)NC2=CSC=N2)C(CC)(CC)O

Isomeric SMILES

CCC(=O)N(C)C(=O)C(C(C(CCC1CCCCC1)O)NC(=O)C(C)NC2=CSC=N2)C(CC)(CC)O

InChI

InChI=1S/C27H46N4O5S/c1-6-22(33)31(5)26(35)23(27(36,7-2)8-3)24(20(32)15-14-19-12-10-9-11-13-19)30-25(34)18(4)29-21-16-37-17-28-21/h16-20,23-24,29,32,36H,6-15H2,1-5H3,(H,30,34)