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

Systemtic Name: ethyl 3-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-1,2,5-thiadiazol-3-yl]propanoate Openeye Name: ethyl 3-[4-[2-hydroxy-3-(isopropylamino)propoxy]-1,2,5-thiadiazol-3-yl]propanoate CAS Name: 3-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-1,2,5-thiadiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]-1,2,5-thiadiazol-3-yl]propanoate Traditional Name: 3-[4-[2-hydroxy-3-(isopropylamino)propoxy]-1,2,5-thiadiazol-3-yl]propionic acid ethyl ester Formula: C13H23N3O4S MolecularWeight: 317.40442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23N3O4S/c1-4-19-12(18)6-5-11-13(16-21-15-11)20-8-10(17)7-14-9(2)3/h9-10,14,17H,4-8H2,1-3H3