2-(2-dimethylaminoethylsulfanyl)pyridine-3-carboxylic acid

Systemtic Name: 2-(2-dimethylaminoethylsulfanyl)pyridine-3-carboxylic acid Openeye Name: 2-(2-dimethylaminoethylsulfanyl)pyridine-3-carboxylic acid CAS Name: 2-(2-dimethylaminoethylthio)-3-pyridinecarboxylic acid IUPAC Name: 2-(2-dimethylaminoethylsulfanyl)pyridine-3-carboxylic acid Traditional Name: 2-(2-dimethylaminoethylthio)nicotinic acid Formula: C10H14N2O2S MolecularWeight: 226.29536

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=C(C=CC=N1)C(=O)O

Isomeric SMILES

CN(C)CCSC1=C(C=CC=N1)C(=O)O

InChI

InChI=1S/C10H14N2O2S/c1-12(2)6-7-15-9-8(10(13)14)4-3-5-11-9/h3-5H,6-7H2,1-2H3,(H,13,14)