(2S)-2-[2-(pyridin-2-ylcarbonylamino)ethylamino]-3-sulfanyl-propanoic acid

Systemtic Name: (2S)-2-[2-(pyridin-2-ylcarbonylamino)ethylamino]-3-sulfanyl-propanoic acid Openeye Name: (2S)-2-[2-(pyridine-2-carbonylamino)ethylamino]-3-sulfanyl-propanoic acid CAS Name: (2S)-3-mercapto-2-[2-[[oxo(2-pyridinyl)methyl]amino]ethylamino]propanoic acid IUPAC Name: (2S)-2-[2-(pyridine-2-carbonylamino)ethylamino]-3-sulfanylpropanoic acid Traditional Name: (2S)-3-mercapto-2-(2-picolinamidoethylamino)propionic acid Formula: C11H15N3O3S MolecularWeight: 269.3201

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=NC(=C1)C(=O)NCCN[C@H](CS)C(=O)O

InChI

InChI=1S/C11H15N3O3S/c15-10(8-3-1-2-4-12-8)14-6-5-13-9(7-18)11(16)17/h1-4,9,13,18H,5-7H2,(H,14,15)(H,16,17)/t9-/m1/s1