Synonyms
(1R,2R)-(+)-N,N'-Di-p-Tosyl-1,2-diphenyl-ethylenediamine; AC1MBZQR; AJ-40730; N,N'-[(1R,2R)-1,2-Diphenylethane-1,2-diyl]bis(4-methylbenzene-1-sulfonamide); SCHEMBL2068549; BC686820; N,N'-((1R,2R)-1,2-Diphenylethane-1,2-diyl)bis(4-methylbenzenesulfonamide); J-004631; (1R,2R)-(+)-N,N'-Di-p-toluenesulfonyl-1,2-diphenyl-1,2-ethylenediamine;
IUPAC Name
4-methyl-N-[(1R,2R)-2-[(4-methylphenyl)sulfonylamino]-1,2-diphenylethyl]benzenesulfonamide;
Molecular Weight
520.662g/mol
Molecular Formula
C28H28N2O4S2;
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)C;
InChI
InChI=1S/C28H28N2O4S2/c1-21-13-17-25(18-14-21)35(31,32)29-27(23-9-5-3-6-10-23)28(24-11-7-4-8-12-24)30-36(33,34)26-19-15-22(2)16-20-26/h3-20,27-30H,1-2H3/t27-,28-/m1/s1;
InChI Key
SJEDVDWSFHJKIZ-VSGBNLITSA-N;
Complexity
794
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Exact Mass
520.149g/mol
H-Bond Acceptor
6
H-Bond Donor
2
Heavy Atom Count
36
Monoisotopic Mass
520.149g/mol
Rotatable Bond Count
9
Topological Polar Surface Area
109A^2
