2-[[2,4-bis(chloranyl)-6-methyl-pyridin-3-yl]methylsulfanyl]benzoic acid

Systemtic Name: 2-[[2,4-bis(chloranyl)-6-methyl-pyridin-3-yl]methylsulfanyl]benzoic acid Openeye Name: 2-[(2,4-dichloro-6-methyl-3-pyridyl)methylsulfanyl]benzoic acid CAS Name: 2-[(2,4-dichloro-6-methyl-3-pyridinyl)methylthio]benzoic acid IUPAC Name: 2-[(2,4-dichloro-6-methylpyridin-3-yl)methylsulfanyl]benzoic acid Traditional Name: 2-[(2,4-dichloro-6-methyl-3-pyridyl)methylthio]benzoic acid Formula: C14H11Cl2NO2S MolecularWeight: 328.21364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)Cl)CSC2=CC=CC=C2C(=O)O)Cl

Isomeric SMILES

CC1=NC(=C(C(=C1)Cl)CSC2=CC=CC=C2C(=O)O)Cl

InChI

InChI=1S/C14H11Cl2NO2S/c1-8-6-11(15)10(13(16)17-8)7-20-12-5-3-2-4-9(12)14(18)19/h2-6H,7H2,1H3,(H,18,19)