2-[furan-2-yl(phenylazanyl)methyl]sulfanylethanoic acid

Systemtic Name: 2-[furan-2-yl(phenylazanyl)methyl]sulfanylethanoic acid Openeye Name: 2-[anilino(2-furyl)methyl]sulfanylacetic acid CAS Name: 2-[[anilino(2-furanyl)methyl]thio]acetic acid IUPAC Name: 2-[anilino(furan-2-yl)methyl]sulfanylacetic acid Traditional Name: 2-[[anilino(2-furyl)methyl]thio]acetic acid Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(C2=CC=CO2)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(C2=CC=CO2)SCC(=O)O

InChI

InChI=1S/C13H13NO3S/c15-12(16)9-18-13(11-7-4-8-17-11)14-10-5-2-1-3-6-10/h1-8,13-14H,9H2,(H,15,16)