(2S)-2-[(5-pyrazin-2-yl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methylamino]propanoic acid

Systemtic Name: (2S)-2-[(5-pyrazin-2-yl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methylamino]propanoic acid Openeye Name: (2S)-2-[(5-pyrazin-2-yl-2-thioxo-1,3,4-oxadiazol-3-yl)methylamino]propanoic acid CAS Name: (2S)-2-[[5-(2-pyrazinyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methylamino]propanoic acid IUPAC Name: (2S)-2-[(5-pyrazin-2-yl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methylamino]propanoic acid Traditional Name: (2S)-2-[(5-pyrazin-2-yl-2-thioxo-1,3,4-oxadiazol-3-yl)methylamino]propionic acid Formula: C10H11N5O3S MolecularWeight: 281.29104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCN1C(=S)OC(=N1)C2=NC=CN=C2

Isomeric SMILES

C[C@@H](C(=O)O)NCN1C(=S)OC(=N1)C2=NC=CN=C2

InChI

InChI=1S/C10H11N5O3S/c1-6(9(16)17)13-5-15-10(19)18-8(14-15)7-4-11-2-3-12-7/h2-4,6,13H,5H2,1H3,(H,16,17)/t6-/m0/s1