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

Systemtic Name: ethyl 4-[[5-(2,2-dimethylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanoate Openeye Name: ethyl 4-[[5-(2,2-dimethylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanoate CAS Name: 4-[[5-[(2,2-dimethyl-1-oxopropyl)amino]-1,3,4-thiadiazol-2-yl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[5-(2,2-dimethylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]butanoate Traditional Name: 4-[[5-(pivaloylamino)-1,3,4-thiadiazol-2-yl]thio]butyric acid ethyl ester Formula: C13H21N3O3S2 MolecularWeight: 331.45414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NN=C(S1)NC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)CCCSC1=NN=C(S1)NC(=O)C(C)(C)C

InChI

InChI=1S/C13H21N3O3S2/c1-5-19-9(17)7-6-8-20-12-16-15-11(21-12)14-10(18)13(2,3)4/h5-8H2,1-4H3,(H,14,15,18)