ethyl 3-[2-[(2-chlorophenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-4-methyl-benzoate

Systemtic Name: ethyl 3-[2-[(2-chlorophenyl)-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-4-methyl-benzoate Openeye Name: ethyl 3-[[2-[2-chloro-N-(p-tolylsulfonyl)anilino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-(2-chloro-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]amino]-4-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2-chloro-N-(4-methylphenyl)sulfonylanilino)acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-(2-chloro-N-tosyl-anilino)acetyl]amino]-4-methyl-benzoic acid ethyl ester Formula: C25H25ClN2O5S MolecularWeight: 500.9944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C)NC(=O)CN(C2=CC=CC=C2Cl)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C)NC(=O)CN(C2=CC=CC=C2Cl)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H25ClN2O5S/c1-4-33-25(30)19-12-11-18(3)22(15-19)27-24(29)16-28(23-8-6-5-7-21(23)26)34(31,32)20-13-9-17(2)10-14-20/h5-15H,4,16H2,1-3H3,(H,27,29)