methyl 3-oxidanyl-2-[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]propanoate

Systemtic Name: methyl 3-oxidanyl-2-[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]propanoate Openeye Name: methyl 3-hydroxy-2-[[2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]propanoate CAS Name: 3-hydroxy-2-[[1-oxo-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]propanoate Traditional Name: 3-hydroxy-2-[[2-[(4-isopropyl-1,2,4-triazol-3-yl)thio]acetyl]amino]propionic acid methyl ester Formula: C11H18N4O4S MolecularWeight: 302.35002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCC(=O)NC(CO)C(=O)OC

Isomeric SMILES

CC(C)N1C=NN=C1SCC(=O)NC(CO)C(=O)OC

InChI

InChI=1S/C11H18N4O4S/c1-7(2)15-6-12-14-11(15)20-5-9(17)13-8(4-16)10(18)19-3/h6-8,16H,4-5H2,1-3H3,(H,13,17)