2-[[5-(3-methylbutylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-(3-methylbutylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-(isopentylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(3-methylbutylamino)-1,3,4-thiadiazol-2-yl]thio]acetate IUPAC Name: 2-[[5-(3-methylbutylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(isoamylamino)-1,3,4-thiadiazol-2-yl]thio]acetate Formula: C9H14N3O2S2- MolecularWeight: 260.35636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NN=C(S1)SCC(=O)[O-]

Isomeric SMILES

CC(C)CCNC1=NN=C(S1)SCC(=O)[O-]

InChI

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