4-[[4,6-bis(chloranyl)-1,3,5-triazin-2-yl]sulfanyl]benzoic acid

Systemtic Name: 4-[[4,6-bis(chloranyl)-1,3,5-triazin-2-yl]sulfanyl]benzoic acid Openeye Name: 4-[(4,6-dichloro-1,3,5-triazin-2-yl)sulfanyl]benzoic acid CAS Name: 4-[(4,6-dichloro-1,3,5-triazin-2-yl)thio]benzoic acid IUPAC Name: 4-[(4,6-dichloro-1,3,5-triazin-2-yl)sulfanyl]benzoic acid Traditional Name: 4-[(4,6-dichloro-s-triazin-2-yl)thio]benzoic acid Formula: C10H5Cl2N3O2S MolecularWeight: 302.1366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)SC2=NC(=NC(=N2)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)SC2=NC(=NC(=N2)Cl)Cl

InChI

InChI=1S/C10H5Cl2N3O2S/c11-8-13-9(12)15-10(14-8)18-6-3-1-5(2-4-6)7(16)17/h1-4H,(H,16,17)