2-(3-azanyl-2-pyridin-2-ylsulfanyl-pyridin-4-yl)butanoic acid

Systemtic Name: 2-(3-azanyl-2-pyridin-2-ylsulfanyl-pyridin-4-yl)butanoic acid Openeye Name: 2-[3-amino-2-(2-pyridylsulfanyl)-4-pyridyl]butanoic acid CAS Name: 2-[3-amino-2-(2-pyridinylthio)-4-pyridinyl]butanoic acid IUPAC Name: 2-(3-amino-2-pyridin-2-ylsulfanylpyridin-4-yl)butanoic acid Traditional Name: 2-[3-amino-2-(2-pyridylthio)-4-pyridyl]butyric acid Formula: C14H15N3O2S MolecularWeight: 289.3528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C(=NC=C1)SC2=CC=CC=N2)N)C(=O)O

Isomeric SMILES

CCC(C1=C(C(=NC=C1)SC2=CC=CC=N2)N)C(=O)O

InChI

InChI=1S/C14H15N3O2S/c1-2-9(14(18)19)10-6-8-17-13(12(10)15)20-11-5-3-4-7-16-11/h3-9H,2,15H2,1H3,(H,18,19)