2-(naphtho[1,2-b][1]benzothiol-5-ylmethylsulfanyl)ethanoic acid

Systemtic Name: 2-(naphtho[1,2-b][1]benzothiol-5-ylmethylsulfanyl)ethanoic acid Openeye Name: 2-(naphtho[1,2-b]benzothiophen-5-ylmethylsulfanyl)acetic acid CAS Name: 2-(5-naphtho[1,2-b][1]benzothiolylmethylthio)acetic acid IUPAC Name: 2-(naphtho[1,2-b][1]benzothiol-5-ylmethylsulfanyl)acetic acid Traditional Name: 2-(naphtho[1,2-b]benzothiophen-5-ylmethylthio)acetic acid Formula: C19H14O2S2 MolecularWeight: 338.44326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC3=C2SC4=CC=CC=C43)CSCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC3=C2SC4=CC=CC=C43)CSCC(=O)O

InChI

InChI=1S/C19H14O2S2/c20-18(21)11-22-10-12-9-16-14-6-3-4-8-17(14)23-19(16)15-7-2-1-5-13(12)15/h1-9H,10-11H2,(H,20,21)