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

Systemtic Name: ethyl (2S)-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxidanylidene-butanoate Openeye Name: ethyl (2S)-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxo-butanoate CAS Name: (2S)-2-[[5-[[(tert-butylamino)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxobutanoate Traditional Name: (2S)-2-[[5-(tert-butylcarbamoylamino)-1,3,4-thiadiazol-2-yl]thio]-3-keto-butyric acid ethyl ester Formula: C13H20N4O4S2 MolecularWeight: 360.4523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)SC1=NN=C(S1)NC(=O)NC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C13H20N4O4S2/c1-6-21-9(19)8(7(2)18)22-12-17-16-11(23-12)14-10(20)15-13(3,4)5/h8H,6H2,1-5H3,(H2,14,15,16,20)/t8-/m0/s1