2-aminocarbonyl-3-[(5-chloranyl-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]-4-phenyl-benzoic acid

Systemtic Name: 2-aminocarbonyl-3-[(5-chloranyl-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]-4-phenyl-benzoic acid Openeye Name: 2-carbamoyl-3-[(5-chloro-2,4-dimethoxy-phenyl)sulfanylcarbamoylamino]-4-phenyl-benzoic acid CAS Name: 2-carbamoyl-3-[[[[(5-chloro-2,4-dimethoxyphenyl)thio]amino]-oxomethyl]amino]-4-phenylbenzoic acid IUPAC Name: 2-carbamoyl-3-[(5-chloro-2,4-dimethoxyphenyl)sulfanylcarbamoylamino]-4-phenylbenzoic acid Traditional Name: 2-carbamoyl-3-[[(5-chloro-2,4-dimethoxy-phenyl)thio]carbamoylamino]-4-phenyl-benzoic acid Formula: C23H20ClN3O6S MolecularWeight: 501.9394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1SNC(=O)NC2=C(C=CC(=C2C(=O)N)C(=O)O)C3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1SNC(=O)NC2=C(C=CC(=C2C(=O)N)C(=O)O)C3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C23H20ClN3O6S/c1-32-16-11-17(33-2)18(10-15(16)24)34-27-23(31)26-20-13(12-6-4-3-5-7-12)8-9-14(22(29)30)19(20)21(25)28/h3-11H,1-2H3,(H2,25,28)(H,29,30)(H2,26,27,31)