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

Systemtic Name: methyl 3-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-1,2,5-thiadiazol-3-yl]propanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C12H21N3O4S MolecularWeight: 303.37784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=NSN=C1CCC(=O)OC)O

Isomeric SMILES

CC(C)NCC(COC1=NSN=C1CCC(=O)OC)O

InChI

InChI=1S/C12H21N3O4S/c1-8(2)13-6-9(16)7-19-12-10(14-20-15-12)4-5-11(17)18-3/h8-9,13,16H,4-7H2,1-3H3