ethyl 3-[[4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]phenyl]carbonylamino]benzoate Openeye Name: ethyl 3-[[4-[(3-methyl-N-methylsulfonyl-anilino)methyl]benzoyl]amino]benzoate CAS Name: 3-[[[4-[(3-methyl-N-methylsulfonylanilino)methyl]phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[4-[(3-methyl-N-methylsulfonylanilino)methyl]benzoyl]amino]benzoate Traditional Name: 3-[[4-[(N-mesyl-3-methyl-anilino)methyl]benzoyl]amino]benzoic acid ethyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)CN(C3=CC=CC(=C3)C)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)CN(C3=CC=CC(=C3)C)S(=O)(=O)C

InChI

InChI=1S/C25H26N2O5S/c1-4-32-25(29)21-8-6-9-22(16-21)26-24(28)20-13-11-19(12-14-20)17-27(33(3,30)31)23-10-5-7-18(2)15-23/h5-16H,4,17H2,1-3H3,(H,26,28)