ethyl 4-[2-[(3,5-dimethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(3,5-dimethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[N-(benzenesulfonyl)-3,5-dimethyl-anilino]acetyl]amino]benzoate CAS Name: 4-[[2-[N-(benzenesulfonyl)-3,5-dimethylanilino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[N-(benzenesulfonyl)-3,5-dimethylanilino]acetyl]amino]benzoate Traditional Name: 4-[[2-(N-besyl-3,5-dimethyl-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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