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2-ethylsulfanyl-6-methyl-quinoline-3-carboxylic acid

2-ethylsulfanyl-6-methyl-quinoline-3-carboxylic acid

Systemtic Name:2-ethylsulfanyl-6-methyl-quinoline-3-carboxylic acid
Openeye Name:2-ethylsulfanyl-6-methyl-quinoline-3-carboxylic acid
CAS Name:2-(ethylthio)-6-methyl-3-quinolinecarboxylic acid
IUPAC Name:2-ethylsulfanyl-6-methylquinoline-3-carboxylic acid
Traditional Name:2-(ethylthio)-6-methyl-quinoline-3-carboxylic acid
Formula: C13H13NO2S
MolecularWeight: 247.31282
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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C2C=C(C=CC2=N1)C)C(=O)O


Isomeric SMILES

CCSC1=C(C=C2C=C(C=CC2=N1)C)C(=O)O


InChI

InChI=1S/C13H13NO2S/c1-3-17-12-10(13(15)16)7-9-6-8(2)4-5-11(9)14-12/h4-7H,3H2,1-2H3,(H,15,16)


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