2-(4-imidazo[1,5-a]pyridin-5-ylbutylsulfanyl)ethanoic acid

Systemtic Name: 2-(4-imidazo[1,5-a]pyridin-5-ylbutylsulfanyl)ethanoic acid Openeye Name: 2-(4-imidazo[1,5-a]pyridin-5-ylbutylsulfanyl)acetic acid CAS Name: 2-[4-(5-imidazo[1,5-a]pyridinyl)butylthio]acetic acid IUPAC Name: 2-(4-imidazo[1,5-a]pyridin-5-ylbutylsulfanyl)acetic acid Traditional Name: 2-(4-imidazo[1,5-a]pyridin-5-ylbutylthio)acetic acid Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CN=CN2C(=C1)CCCCSCC(=O)O

Isomeric SMILES

C1=CC2=CN=CN2C(=C1)CCCCSCC(=O)O

InChI

InChI=1S/C13H16N2O2S/c16-13(17)9-18-7-2-1-4-11-5-3-6-12-8-14-10-15(11)12/h3,5-6,8,10H,1-2,4,7,9H2,(H,16,17)