N-[5-(6-methyl-6-oxidanyl-heptan-2-yl)-1,3-thiazol-2-yl]-2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]propanamide

Systemtic Name: N-[5-(6-methyl-6-oxidanyl-heptan-2-yl)-1,3-thiazol-2-yl]-2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]propanamide Openeye Name: N-[5-(5-hydroxy-1,5-dimethyl-hexyl)thiazol-2-yl]-2-[(2-hydroxy-2-phenyl-acetyl)amino]propanamide CAS Name: N-[5-(6-hydroxy-6-methylheptan-2-yl)-2-thiazolyl]-2-[(2-hydroxy-1-oxo-2-phenylethyl)amino]propanamide IUPAC Name: N-[5-(6-hydroxy-6-methylheptan-2-yl)-1,3-thiazol-2-yl]-2-[(2-hydroxy-2-phenylacetyl)amino]propanamide Traditional Name: N-[5-(5-hydroxy-1,5-dimethyl-hexyl)thiazol-2-yl]-2-(mandeloylamino)propionamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(C)(C)O)C1=CN=C(S1)NC(=O)C(C)NC(=O)C(C2=CC=CC=C2)O

Isomeric SMILES

CC(CCCC(C)(C)O)C1=CN=C(S1)NC(=O)C(C)NC(=O)C(C2=CC=CC=C2)O

InChI

InChI=1S/C22H31N3O4S/c1-14(9-8-12-22(3,4)29)17-13-23-21(30-17)25-19(27)15(2)24-20(28)18(26)16-10-6-5-7-11-16/h5-7,10-11,13-15,18,26,29H,8-9,12H2,1-4H3,(H,24,28)(H,23,25,27)