[2-[methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl] 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]ethanoate

Systemtic Name: [2-[methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl] 2-[(4-bromanyl-2-chloranyl-phenyl)sulfonylamino]ethanoate Openeye Name: [2-[methyl-[2-(4-methylanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl] 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetic acid [2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl] 2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-bromo-2-chloro-phenyl)sulfonylamino]acetic acid [2-keto-2-[[2-keto-2-(p-toluidino)ethyl]-methyl-amino]ethyl] ester Formula: C20H21BrClN3O6S MolecularWeight: 546.81924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)COC(=O)CNS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)COC(=O)CNS(=O)(=O)C2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C20H21BrClN3O6S/c1-13-3-6-15(7-4-13)24-18(26)11-25(2)19(27)12-31-20(28)10-23-32(29,30)17-8-5-14(21)9-16(17)22/h3-9,23H,10-12H2,1-2H3,(H,24,26)