3-[3-[5-(3-methylbutanoylamino)thiophen-3-yl]-1,2,4-oxadiazol-5-yl]propanoic acid

Systemtic Name: 3-[3-[5-(3-methylbutanoylamino)thiophen-3-yl]-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: 3-[3-[5-(3-methylbutanoylamino)-3-thienyl]-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: 3-[3-[5-[(3-methyl-1-oxobutyl)amino]-3-thiophenyl]-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: 3-[3-[5-(3-methylbutanoylamino)thiophen-3-yl]-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: 3-[3-[5-(isovalerylamino)-3-thienyl]-1,2,4-oxadiazol-5-yl]propionic acid Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC(=CS1)C2=NOC(=N2)CCC(=O)O

Isomeric SMILES

CC(C)CC(=O)NC1=CC(=CS1)C2=NOC(=N2)CCC(=O)O

InChI

InChI=1S/C14H17N3O4S/c1-8(2)5-10(18)15-12-6-9(7-22-12)14-16-11(21-17-14)3-4-13(19)20/h6-8H,3-5H2,1-2H3,(H,15,18)(H,19,20)