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

Systemtic Name: ethyl 4-[[4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]phenyl]carbonylamino]-3-methyl-benzoate Openeye Name: ethyl 4-[[4-[ethyl-(4-methylsulfanylphenyl)sulfonyl-amino]benzoyl]amino]-3-methyl-benzoate CAS Name: 4-[[[4-[ethyl-[4-(methylthio)phenyl]sulfonylamino]phenyl]-oxomethyl]amino]-3-methylbenzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[ethyl-(4-methylsulfanylphenyl)sulfonylamino]benzoyl]amino]-3-methylbenzoate Traditional Name: 4-[[4-[ethyl-[4-(methylthio)phenyl]sulfonyl-amino]benzoyl]amino]-3-methyl-benzoic acid ethyl ester Formula: C26H28N2O5S2 MolecularWeight: 512.64092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O5S2/c1-5-28(35(31,32)23-14-12-22(34-4)13-15-23)21-10-7-19(8-11-21)25(29)27-24-16-9-20(17-18(24)3)26(30)33-6-2/h7-17H,5-6H2,1-4H3,(H,27,29)