2-[5-(furan-2-ylmethylsulfanylmethyl)furan-2-yl]-2-[(4-iodophenyl)amino]ethanoic acid

Systemtic Name: 2-[5-(furan-2-ylmethylsulfanylmethyl)furan-2-yl]-2-[(4-iodophenyl)amino]ethanoic acid Openeye Name: 2-[5-(2-furylmethylsulfanylmethyl)-2-furyl]-2-(4-iodoanilino)acetic acid CAS Name: 2-[5-[(2-furanylmethylthio)methyl]-2-furanyl]-2-(4-iodoanilino)acetic acid IUPAC Name: 2-[5-(furan-2-ylmethylsulfanylmethyl)furan-2-yl]-2-(4-iodoanilino)acetic acid Traditional Name: 2-[5-[(2-furfurylthio)methyl]-2-furyl]-2-(4-iodoanilino)acetic acid Formula: C18H16INO4S MolecularWeight: 469.29341

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CSCC2=CC=C(O2)C(C(=O)O)NC3=CC=C(C=C3)I

Isomeric SMILES

C1=COC(=C1)CSCC2=CC=C(O2)C(C(=O)O)NC3=CC=C(C=C3)I

InChI

InChI=1S/C18H16INO4S/c19-12-3-5-13(6-4-12)20-17(18(21)22)16-8-7-15(24-16)11-25-10-14-2-1-9-23-14/h1-9,17,20H,10-11H2,(H,21,22)