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

Systemtic Name: 2-[(2-ethylphenyl)amino]-2-[5-(furan-2-ylmethylsulfanylmethyl)furan-2-yl]ethanoic acid Openeye Name: 2-(2-ethylanilino)-2-[5-(2-furylmethylsulfanylmethyl)-2-furyl]acetic acid CAS Name: 2-(2-ethylanilino)-2-[5-[(2-furanylmethylthio)methyl]-2-furanyl]acetic acid IUPAC Name: 2-(2-ethylanilino)-2-[5-(furan-2-ylmethylsulfanylmethyl)furan-2-yl]acetic acid Traditional Name: 2-(2-ethylanilino)-2-[5-[(2-furfurylthio)methyl]-2-furyl]acetic acid Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(C2=CC=C(O2)CSCC3=CC=CO3)C(=O)O

Isomeric SMILES

CCC1=CC=CC=C1NC(C2=CC=C(O2)CSCC3=CC=CO3)C(=O)O

InChI

InChI=1S/C20H21NO4S/c1-2-14-6-3-4-8-17(14)21-19(20(22)23)18-10-9-16(25-18)13-26-12-15-7-5-11-24-15/h3-11,19,21H,2,12-13H2,1H3,(H,22,23)