2-[2-(pyrazin-2-ylcarbonylamino)ethylamino]-4-sulfanyl-butanoic acid

Systemtic Name: 2-[2-(pyrazin-2-ylcarbonylamino)ethylamino]-4-sulfanyl-butanoic acid Openeye Name: 2-[2-(pyrazine-2-carbonylamino)ethylamino]-4-sulfanyl-butanoic acid CAS Name: 4-mercapto-2-[2-[[oxo(2-pyrazinyl)methyl]amino]ethylamino]butanoic acid IUPAC Name: 2-[2-(pyrazine-2-carbonylamino)ethylamino]-4-sulfanylbutanoic acid Traditional Name: 4-mercapto-2-[2-(pyrazinoylamino)ethylamino]butyric acid Formula: C11H16N4O3S MolecularWeight: 284.33474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=N1)C(=O)NCCNC(CCS)C(=O)O

Isomeric SMILES

C1=CN=C(C=N1)C(=O)NCCNC(CCS)C(=O)O

InChI

InChI=1S/C11H16N4O3S/c16-10(9-7-12-2-3-14-9)15-5-4-13-8(1-6-19)11(17)18/h2-3,7-8,13,19H,1,4-6H2,(H,15,16)(H,17,18)