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

Systemtic Name: methyl 3-[4-[3-[[2-methyl-1-(morpholin-4-ylcarbonylamino)propan-2-yl]amino]-2-oxidanyl-propoxy]-1,2,5-thiadiazol-3-yl]propanoate Openeye Name: methyl 3-[4-[3-[[1,1-dimethyl-2-(morpholine-4-carbonylamino)ethyl]amino]-2-hydroxy-propoxy]-1,2,5-thiadiazol-3-yl]propanoate CAS Name: 3-[4-[2-hydroxy-3-[[2-methyl-1-[[4-morpholinyl(oxo)methyl]amino]propan-2-yl]amino]propoxy]-1,2,5-thiadiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[2-hydroxy-3-[[2-methyl-1-(morpholine-4-carbonylamino)propan-2-yl]amino]propoxy]-1,2,5-thiadiazol-3-yl]propanoate Traditional Name: 3-[4-[3-[[1,1-dimethyl-2-(morpholine-4-carbonylamino)ethyl]amino]-2-hydroxy-propoxy]-1,2,5-thiadiazol-3-yl]propionic acid methyl ester Formula: C18H31N5O6S MolecularWeight: 445.53364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)N1CCOCC1)NCC(COC2=NSN=C2CCC(=O)OC)O

Isomeric SMILES

CC(C)(CNC(=O)N1CCOCC1)NCC(COC2=NSN=C2CCC(=O)OC)O

InChI

InChI=1S/C18H31N5O6S/c1-18(2,12-19-17(26)23-6-8-28-9-7-23)20-10-13(24)11-29-16-14(21-30-22-16)4-5-15(25)27-3/h13,20,24H,4-12H2,1-3H3,(H,19,26)