2-(2-ethylsulfanyl-5-methyl-phenyl)indolizine-1-carboxylic acid

Systemtic Name: 2-(2-ethylsulfanyl-5-methyl-phenyl)indolizine-1-carboxylic acid Openeye Name: 2-(2-ethylsulfanyl-5-methyl-phenyl)indolizine-1-carboxylic acid CAS Name: 2-[2-(ethylthio)-5-methylphenyl]-1-indolizinecarboxylic acid IUPAC Name: 2-(2-ethylsulfanyl-5-methylphenyl)indolizine-1-carboxylic acid Traditional Name: 2-[2-(ethylthio)-5-methyl-phenyl]indolizine-1-carboxylic acid Formula: C18H17NO2S MolecularWeight: 311.39808

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C(C=C1)C)C2=CN3C=CC=CC3=C2C(=O)O

Isomeric SMILES

CCSC1=C(C=C(C=C1)C)C2=CN3C=CC=CC3=C2C(=O)O

InChI

InChI=1S/C18H17NO2S/c1-3-22-16-8-7-12(2)10-13(16)14-11-19-9-5-4-6-15(19)17(14)18(20)21/h4-11H,3H2,1-2H3,(H,20,21)