N-[5-(2-methylpentan-2-yl)-1,3,4-thiadiazol-2-yl]-2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]pentanamide

Systemtic Name: N-[5-(2-methylpentan-2-yl)-1,3,4-thiadiazol-2-yl]-2-[(2-oxidanyl-2-phenyl-ethanoyl)amino]pentanamide Openeye Name: N-[5-(1,1-dimethylbutyl)-1,3,4-thiadiazol-2-yl]-2-[(2-hydroxy-2-phenyl-acetyl)amino]pentanamide CAS Name: 2-[(2-hydroxy-1-oxo-2-phenylethyl)amino]-N-[5-(2-methylpentan-2-yl)-1,3,4-thiadiazol-2-yl]pentanamide IUPAC Name: 2-[(2-hydroxy-2-phenylacetyl)amino]-N-[5-(2-methylpentan-2-yl)-1,3,4-thiadiazol-2-yl]pentanamide Traditional Name: N-[5-(1,1-dimethylbutyl)-1,3,4-thiadiazol-2-yl]-2-(mandeloylamino)valeramide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=NN=C(S1)C(C)(C)CCC)NC(=O)C(C2=CC=CC=C2)O

Isomeric SMILES

CCCC(C(=O)NC1=NN=C(S1)C(C)(C)CCC)NC(=O)C(C2=CC=CC=C2)O

InChI

InChI=1S/C21H30N4O3S/c1-5-10-15(22-18(28)16(26)14-11-8-7-9-12-14)17(27)23-20-25-24-19(29-20)21(3,4)13-6-2/h7-9,11-12,15-16,26H,5-6,10,13H2,1-4H3,(H,22,28)(H,23,25,27)