2-[[5-(3-methylbutylcarbamoyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[5-(3-methylbutylcarbamoyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[5-(isopentylcarbamoyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]acetic acid CAS Name: 2-[[5-[(3-methylbutylamino)-oxomethyl]-1,2,4-oxadiazol-3-yl]methylthio]acetic acid IUPAC Name: 2-[[5-(3-methylbutylcarbamoyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]acetic acid Traditional Name: 2-[[5-(isoamylcarbamoyl)-1,2,4-oxadiazol-3-yl]methylthio]acetic acid Formula: C11H17N3O4S MolecularWeight: 287.33538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=NC(=NO1)CSCC(=O)O

Isomeric SMILES

CC(C)CCNC(=O)C1=NC(=NO1)CSCC(=O)O

InChI

InChI=1S/C11H17N3O4S/c1-7(2)3-4-12-10(17)11-13-8(14-18-11)5-19-6-9(15)16/h7H,3-6H2,1-2H3,(H,12,17)(H,15,16)