2-[2-[(4-acetamidophenyl)sulfanylcarbamoylamino]-4-chloranyl-5-ethoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[2-[(4-acetamidophenyl)sulfanylcarbamoylamino]-4-chloranyl-5-ethoxy-phenoxy]ethanoic acid Openeye Name: 2-[2-[(4-acetamidophenyl)sulfanylcarbamoylamino]-4-chloro-5-ethoxy-phenoxy]acetic acid CAS Name: 2-[2-[[[[(4-acetamidophenyl)thio]amino]-oxomethyl]amino]-4-chloro-5-ethoxyphenoxy]acetic acid IUPAC Name: 2-[2-[(4-acetamidophenyl)sulfanylcarbamoylamino]-4-chloro-5-ethoxyphenoxy]acetic acid Traditional Name: 2-[2-[[(4-acetamidophenyl)thio]carbamoylamino]-4-chloro-5-ethoxy-phenoxy]acetic acid Formula: C19H20ClN3O6S MolecularWeight: 453.8966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)OCC(=O)O)NC(=O)NSC2=CC=C(C=C2)NC(=O)C)Cl

Isomeric SMILES

CCOC1=C(C=C(C(=C1)OCC(=O)O)NC(=O)NSC2=CC=C(C=C2)NC(=O)C)Cl

InChI

InChI=1S/C19H20ClN3O6S/c1-3-28-16-9-17(29-10-18(25)26)15(8-14(16)20)22-19(27)23-30-13-6-4-12(5-7-13)21-11(2)24/h4-9H,3,10H2,1-2H3,(H,21,24)(H,25,26)(H2,22,23,27)