3-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoic acid

Systemtic Name: 3-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoic acid Openeye Name: 3-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoic acid CAS Name: 3-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]thio]propanoic acid IUPAC Name: 3-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoic acid Traditional Name: 3-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]thio]propionic acid Formula: C9H15N3O2S2 MolecularWeight: 261.3643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NN=C(S1)SCCC(=O)O

Isomeric SMILES

CC(C)CNC1=NN=C(S1)SCCC(=O)O

InChI

InChI=1S/C9H15N3O2S2/c1-6(2)5-10-8-11-12-9(16-8)15-4-3-7(13)14/h6H,3-5H2,1-2H3,(H,10,11)(H,13,14)