(2S,3R)-2-diethoxyphosphoryl-3-phenyl-1-(2,4,6-trimethylphenyl)sulfinyl-aziridine

Systemtic Name: (2S,3R)-2-diethoxyphosphoryl-3-phenyl-1-(2,4,6-trimethylphenyl)sulfinyl-aziridine Openeye Name: (2S,3R)-2-diethoxyphosphoryl-3-phenyl-1-(2,4,6-trimethylphenyl)sulfinyl-aziridine CAS Name: (2S,3R)-2-diethoxyphosphoryl-3-phenyl-1-(2,4,6-trimethylphenyl)sulfinylaziridine IUPAC Name: (2S,3R)-2-diethoxyphosphoryl-3-phenyl-1-(2,4,6-trimethylphenyl)sulfinylaziridine Traditional Name: (2S,3R)-2-diethoxyphosphoryl-1-mesitylsulfinyl-3-phenyl-ethylenimine Formula: C21H28NO4PS MolecularWeight: 421.490081

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1C(N1S(=O)C2=C(C=C(C=C2C)C)C)C3=CC=CC=C3)OCC

Isomeric SMILES

CCOP(=O)([C@H]1[C@H](N1S(=O)C2=C(C=C(C=C2C)C)C)C3=CC=CC=C3)OCC

InChI

InChI=1S/C21H28NO4PS/c1-6-25-27(23,26-7-2)21-19(18-11-9-8-10-12-18)22(21)28(24)20-16(4)13-15(3)14-17(20)5/h8-14,19,21H,6-7H2,1-5H3/t19-,21+,22?,28?/m1/s1