methyl (2R)-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanoate

Systemtic Name: methyl (2R)-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanoate Openeye Name: methyl (2R)-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanoate CAS Name: (2R)-2-[[5-[[(tert-butylamino)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]thio]butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanoate Traditional Name: (2R)-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]thio]butyric acid methyl ester Formula: C12H20N4O3S2 MolecularWeight: 332.4422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC)SC1=NN=C(S1)NC(=O)NC(C)(C)C

Isomeric SMILES

CC[C@H](C(=O)OC)SC1=NN=C(S1)NC(=O)NC(C)(C)C

InChI

InChI=1S/C12H20N4O3S2/c1-6-7(8(17)19-5)20-11-16-15-10(21-11)13-9(18)14-12(2,3)4/h7H,6H2,1-5H3,(H2,13,14,15,18)/t7-/m1/s1