Synonyms
ST2402122; (1S,2S)-TSDPEN; C21H22N2O2S; EBD12781; AJ-48759; CBiol_000203; (S,S)-TSDPEN; CTK3J8236; BBL102186; (1s,2s)-(+)-n-(4-toluenesulphonyl)-1,2-diphenylethylenediamine;
IUPAC Name
N-[(1S,2S)-2-amino-1,2-diphenylethyl]-4-methylbenzenesulfonamide;
Molecular Weight
366.479g/mol
Molecular Formula
C21H22N2O2S;
Canonical SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(C3=CC=CC=C3)N;
InChI
InChI=1S/C21H22N2O2S/c1-16-12-14-19(15-13-16)26(24,25)23-21(18-10-6-3-7-11-18)20(22)17-8-4-2-5-9-17/h2-15,20-21,23H,22H2,1H3/t20-,21-/m0/s1;
InChI Key
UOPFIWYXBIHPIP-SFTDATJTSA-N;
Complexity
511
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Exact Mass
366.14g/mol
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
26
Monoisotopic Mass
366.14g/mol
Rotatable Bond Count
6
Topological Polar Surface Area
80.6A^2
