5-[(2-azanyl-6-chloranyl-phenyl)sulfanylmethyl]furan-2-carboxylic acid

Systemtic Name: 5-[(2-azanyl-6-chloranyl-phenyl)sulfanylmethyl]furan-2-carboxylic acid Openeye Name: 5-[(2-amino-6-chloro-phenyl)sulfanylmethyl]furan-2-carboxylic acid CAS Name: 5-[[(2-amino-6-chlorophenyl)thio]methyl]-2-furancarboxylic acid IUPAC Name: 5-[(2-amino-6-chlorophenyl)sulfanylmethyl]furan-2-carboxylic acid Traditional Name: 5-[[(2-amino-6-chloro-phenyl)thio]methyl]-2-furoic acid Formula: C12H10ClNO3S MolecularWeight: 283.7307

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)SCC2=CC=C(O2)C(=O)O)N

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)SCC2=CC=C(O2)C(=O)O)N

InChI

InChI=1S/C12H10ClNO3S/c13-8-2-1-3-9(14)11(8)18-6-7-4-5-10(17-7)12(15)16/h1-5H,6,14H2,(H,15,16)