ethyl 3-[2-[(2,3-dimethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]-4-methyl-benzoate

Systemtic Name: ethyl 3-[2-[(2,3-dimethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]-4-methyl-benzoate Openeye Name: ethyl 3-[[2-[N-(benzenesulfonyl)-2,3-dimethyl-anilino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[N-(benzenesulfonyl)-2,3-dimethylanilino]-1-oxoethyl]amino]-4-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[N-(benzenesulfonyl)-2,3-dimethylanilino]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(N-besyl-2,3-dimethyl-anilino)acetyl]amino]-4-methyl-benzoic acid ethyl ester Formula: C26H28N2O5S MolecularWeight: 480.57592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C)NC(=O)CN(C2=CC=CC(=C2C)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C)NC(=O)CN(C2=CC=CC(=C2C)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H28N2O5S/c1-5-33-26(30)21-15-14-19(3)23(16-21)27-25(29)17-28(24-13-9-10-18(2)20(24)4)34(31,32)22-11-7-6-8-12-22/h6-16H,5,17H2,1-4H3,(H,27,29)