ethyl 3-[4-[3-(2-methylbut-3-yn-2-ylamino)-2-oxidanyl-propoxy]-1,2,5-thiadiazol-3-yl]propanoate

Systemtic Name: ethyl 3-[4-[3-(2-methylbut-3-yn-2-ylamino)-2-oxidanyl-propoxy]-1,2,5-thiadiazol-3-yl]propanoate Openeye Name: ethyl 3-[4-[3-(1,1-dimethylprop-2-ynylamino)-2-hydroxy-propoxy]-1,2,5-thiadiazol-3-yl]propanoate CAS Name: 3-[4-[2-hydroxy-3-(2-methylbut-3-yn-2-ylamino)propoxy]-1,2,5-thiadiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[2-hydroxy-3-(2-methylbut-3-yn-2-ylamino)propoxy]-1,2,5-thiadiazol-3-yl]propanoate Traditional Name: 3-[4-[3-(1,1-dimethylprop-2-ynylamino)-2-hydroxy-propoxy]-1,2,5-thiadiazol-3-yl]propionic acid ethyl ester Formula: C15H23N3O4S MolecularWeight: 341.42582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=NSN=C1OCC(CNC(C)(C)C#C)O

Isomeric SMILES

CCOC(=O)CCC1=NSN=C1OCC(CNC(C)(C)C#C)O

InChI

InChI=1S/C15H23N3O4S/c1-5-15(3,4)16-9-11(19)10-22-14-12(17-23-18-14)7-8-13(20)21-6-2/h1,11,16,19H,6-10H2,2-4H3