2-(2-methylsulfanyl-3-pyridin-4-yl-propyl)pentanedioic acid

Systemtic Name: 2-(2-methylsulfanyl-3-pyridin-4-yl-propyl)pentanedioic acid Openeye Name: 2-[2-methylsulfanyl-3-(4-pyridyl)propyl]pentanedioic acid CAS Name: 2-[2-(methylthio)-3-pyridin-4-ylpropyl]pentanedioic acid IUPAC Name: 2-(2-methylsulfanyl-3-pyridin-4-ylpropyl)pentanedioic acid Traditional Name: 2-[2-(methylthio)-3-(4-pyridyl)propyl]glutaric acid Formula: C14H19NO4S MolecularWeight: 297.36996

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC1=CC=NC=C1)CC(CCC(=O)O)C(=O)O

Isomeric SMILES

CSC(CC1=CC=NC=C1)CC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C14H19NO4S/c1-20-12(8-10-4-6-15-7-5-10)9-11(14(18)19)2-3-13(16)17/h4-7,11-12H,2-3,8-9H2,1H3,(H,16,17)(H,18,19)