2-[3-[(2R)-2-[[(2R)-2-[3-(methylsulfonylamino)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]propyl]phenyl]-N-[[2,3,6-tris(chloranyl)phenyl]methyl]ethanamide

Systemtic Name: 2-[3-[(2R)-2-[[(2R)-2-[3-(methylsulfonylamino)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]propyl]phenyl]-N-[[2,3,6-tris(chloranyl)phenyl]methyl]ethanamide Openeye Name: 2-[3-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]propyl]phenyl]-N-[(2,3,6-trichlorophenyl)methyl]acetamide CAS Name: 2-[3-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]propyl]phenyl]-N-[(2,3,6-trichlorophenyl)methyl]acetamide IUPAC Name: 2-[3-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]propyl]phenyl]-N-[(2,3,6-trichlorophenyl)methyl]acetamide Traditional Name: 2-[3-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]propyl]phenyl]-N-(2,3,6-trichlorobenzyl)acetamide Formula: C27H30Cl3N3O5S MolecularWeight: 614.9682

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC(=C1)CC(=O)NCC2=C(C=CC(=C2Cl)Cl)Cl)NCC(C3=CC(=C(C=C3)O)NS(=O)(=O)C)O

Isomeric SMILES

C[C@H](CC1=CC=CC(=C1)CC(=O)NCC2=C(C=CC(=C2Cl)Cl)Cl)NC[C@@H](C3=CC(=C(C=C3)O)NS(=O)(=O)C)O

InChI

InChI=1S/C27H30Cl3N3O5S/c1-16(31-15-25(35)19-6-9-24(34)23(13-19)33-39(2,37)38)10-17-4-3-5-18(11-17)12-26(36)32-14-20-21(28)7-8-22(29)27(20)30/h3-9,11,13,16,25,31,33-35H,10,12,14-15H2,1-2H3,(H,32,36)/t16-,25+/m1/s1