5-azanyl-5-oxidanylidene-2-(2-pyridin-4-ylsulfanylethanoylamino)pentanoic acid

Systemtic Name: 5-azanyl-5-oxidanylidene-2-(2-pyridin-4-ylsulfanylethanoylamino)pentanoic acid Openeye Name: 5-amino-5-oxo-2-[[2-(4-pyridylsulfanyl)acetyl]amino]pentanoic acid CAS Name: 5-amino-5-oxo-2-[[1-oxo-2-(pyridin-4-ylthio)ethyl]amino]pentanoic acid IUPAC Name: 5-amino-5-oxo-2-[(2-pyridin-4-ylsulfanylacetyl)amino]pentanoic acid Traditional Name: 5-amino-5-keto-2-[[2-(4-pyridylthio)acetyl]amino]valeric acid Formula: C12H15N3O4S MolecularWeight: 297.3302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1SCC(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

C1=CN=CC=C1SCC(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C12H15N3O4S/c13-10(16)2-1-9(12(18)19)15-11(17)7-20-8-3-5-14-6-4-8/h3-6,9H,1-2,7H2,(H2,13,16)(H,15,17)(H,18,19)