2-[(3-chlorophenyl)amino]-2-[5-(sulfanylmethyl)furan-2-yl]ethanoic acid

Systemtic Name: 2-[(3-chlorophenyl)amino]-2-[5-(sulfanylmethyl)furan-2-yl]ethanoic acid Openeye Name: 2-(3-chloroanilino)-2-[5-(sulfanylmethyl)-2-furyl]acetic acid CAS Name: 2-(3-chloroanilino)-2-[5-(mercaptomethyl)-2-furanyl]acetic acid IUPAC Name: 2-(3-chloroanilino)-2-[5-(sulfanylmethyl)furan-2-yl]acetic acid Traditional Name: 2-(3-chloroanilino)-2-[5-(mercaptomethyl)-2-furyl]acetic acid Formula: C13H12ClNO3S MolecularWeight: 297.75728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(C2=CC=C(O2)CS)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(C2=CC=C(O2)CS)C(=O)O

InChI

InChI=1S/C13H12ClNO3S/c14-8-2-1-3-9(6-8)15-12(13(16)17)11-5-4-10(7-19)18-11/h1-6,12,15,19H,7H2,(H,16,17)