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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=NN=C(S1)SCCCC(=O)OCC

Isomeric SMILES

CCCCC(=O)NC1=NN=C(S1)SCCCC(=O)OCC

InChI

InChI=1S/C13H21N3O3S2/c1-3-5-7-10(17)14-12-15-16-13(21-12)20-9-6-8-11(18)19-4-2/h3-9H2,1-2H3,(H,14,15,17)