ethyl 3-chloranyl-4-[[4-[methyl-(4-methylsulfanylphenyl)sulfonyl-amino]phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 3-chloranyl-4-[[4-[methyl-(4-methylsulfanylphenyl)sulfonyl-amino]phenyl]carbonylamino]benzoate Openeye Name: ethyl 3-chloro-4-[[4-[methyl-(4-methylsulfanylphenyl)sulfonyl-amino]benzoyl]amino]benzoate CAS Name: 3-chloro-4-[[[4-[methyl-[4-(methylthio)phenyl]sulfonylamino]phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-chloro-4-[[4-[methyl-(4-methylsulfanylphenyl)sulfonylamino]benzoyl]amino]benzoate Traditional Name: 3-chloro-4-[[4-[methyl-[4-(methylthio)phenyl]sulfonyl-amino]benzoyl]amino]benzoic acid ethyl ester Formula: C24H23ClN2O5S2 MolecularWeight: 519.03282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)SC)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=C(C=C3)SC)Cl

InChI

InChI=1S/C24H23ClN2O5S2/c1-4-32-24(29)17-7-14-22(21(25)15-17)26-23(28)16-5-8-18(9-6-16)27(2)34(30,31)20-12-10-19(33-3)11-13-20/h5-15H,4H2,1-3H3,(H,26,28)