tert-butyl 2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: tert-butyl 2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: tert-butyl 2-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid tert-butyl ester Formula: C12H21N3O2S2 MolecularWeight: 303.44404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NN=C(S1)SCC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CNC1=NN=C(S1)SCC(=O)OC(C)(C)C

InChI

InChI=1S/C12H21N3O2S2/c1-8(2)6-13-10-14-15-11(19-10)18-7-9(16)17-12(3,4)5/h8H,6-7H2,1-5H3,(H,13,14)