methyl 2-[[[5-bromanyl-2-[(4-methylphenyl)sulfonylamino]phenyl]-phenyl-methyl]amino]ethanoate

Systemtic Name: methyl 2-[[[5-bromanyl-2-[(4-methylphenyl)sulfonylamino]phenyl]-phenyl-methyl]amino]ethanoate Openeye Name: methyl 2-[[[5-bromo-2-(p-tolylsulfonylamino)phenyl]-phenyl-methyl]amino]acetate CAS Name: 2-[[[5-bromo-2-[(4-methylphenyl)sulfonylamino]phenyl]-phenylmethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[[5-bromo-2-[(4-methylphenyl)sulfonylamino]phenyl]-phenylmethyl]amino]acetate Traditional Name: 2-[[[5-bromo-2-(tosylamino)phenyl]-phenyl-methyl]amino]acetic acid methyl ester Formula: C23H23BrN2O4S MolecularWeight: 503.40872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Br)C(C3=CC=CC=C3)NCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Br)C(C3=CC=CC=C3)NCC(=O)OC

InChI

InChI=1S/C23H23BrN2O4S/c1-16-8-11-19(12-9-16)31(28,29)26-21-13-10-18(24)14-20(21)23(25-15-22(27)30-2)17-6-4-3-5-7-17/h3-14,23,25-26H,15H2,1-2H3