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

Systemtic Name: 2-[2-(pyridin-2-ylcarbonylamino)ethylamino]-4-sulfanyl-butanoic acid Openeye Name: 2-[2-(pyridine-2-carbonylamino)ethylamino]-4-sulfanyl-butanoic acid CAS Name: 4-mercapto-2-[2-[[oxo(2-pyridinyl)methyl]amino]ethylamino]butanoic acid IUPAC Name: 2-[2-(pyridine-2-carbonylamino)ethylamino]-4-sulfanylbutanoic acid Traditional Name: 4-mercapto-2-(2-picolinamidoethylamino)butyric acid Formula: C12H17N3O3S MolecularWeight: 283.34668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(=O)NCCNC(CCS)C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)C(=O)NCCNC(CCS)C(=O)O

InChI

InChI=1S/C12H17N3O3S/c16-11(9-3-1-2-5-13-9)15-7-6-14-10(4-8-19)12(17)18/h1-3,5,10,14,19H,4,6-8H2,(H,15,16)(H,17,18)