2-azanyl-3-[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-oxo-2-[(1,3,5-trimethyl-4-pyrazolyl)amino]ethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-keto-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]thio]propionic acid Formula: C11H18N4O3S MolecularWeight: 286.35062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CSCC(C(=O)O)N

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C11H18N4O3S/c1-6-10(7(2)15(3)14-6)13-9(16)5-19-4-8(12)11(17)18/h8H,4-5,12H2,1-3H3,(H,13,16)(H,17,18)