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

Systemtic Name: methyl 3-[[4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]phenyl]carbonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]benzoyl]amino]-4-methyl-benzoate CAS Name: 3-[[[4-[ethyl-[4-(methylthio)phenyl]sulfonylamino]phenyl]-oxomethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[4-[ethyl-(4-methylsulfanylphenyl)sulfonylamino]benzoyl]amino]-4-methylbenzoate Traditional Name: 3-[[4-[ethyl-[4-(methylthio)phenyl]sulfonyl-amino]benzoyl]amino]-4-methyl-benzoic acid methyl ester Formula: C25H26N2O5S2 MolecularWeight: 498.61434

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCN(C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C25H26N2O5S2/c1-5-27(34(30,31)22-14-12-21(33-4)13-15-22)20-10-8-18(9-11-20)24(28)26-23-16-19(25(29)32-3)7-6-17(23)2/h6-16H,5H2,1-4H3,(H,26,28)