2-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-(4-chloranyl-3-methoxy-phenoxy)ethanoic acid

Systemtic Name: 2-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-(4-chloranyl-3-methoxy-phenoxy)ethanoic acid Openeye Name: 2-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-(4-chloro-3-methoxy-phenoxy)acetic acid CAS Name: 2-[[[[(4-acetamidophenyl)thio]amino]-oxomethyl]amino]-2-(4-chloro-3-methoxyphenoxy)acetic acid IUPAC Name: 2-[(4-acetamidophenyl)sulfanylcarbamoylamino]-2-(4-chloro-3-methoxyphenoxy)acetic acid Traditional Name: 2-[[(4-acetamidophenyl)thio]carbamoylamino]-2-(4-chloro-3-methoxy-phenoxy)acetic acid Formula: C18H18ClN3O6S MolecularWeight: 439.87002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SNC(=O)NC(C(=O)O)OC2=CC(=C(C=C2)Cl)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SNC(=O)NC(C(=O)O)OC2=CC(=C(C=C2)Cl)OC

InChI

InChI=1S/C18H18ClN3O6S/c1-10(23)20-11-3-6-13(7-4-11)29-22-18(26)21-16(17(24)25)28-12-5-8-14(19)15(9-12)27-2/h3-9,16H,1-2H3,(H,20,23)(H,24,25)(H2,21,22,26)