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

Systemtic Name: ethyl (2R)-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanoate Openeye Name: ethyl (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 ethyl ester IUPAC Name: ethyl (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 ethyl ester Formula: C13H22N4O3S2 MolecularWeight: 346.46878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N4O3S2/c1-6-8(9(18)20-7-2)21-12-17-16-11(22-12)14-10(19)15-13(3,4)5/h8H,6-7H2,1-5H3,(H2,14,15,16,19)/t8-/m1/s1