(4-bromophenyl)-[(2R,3S)-1-(4-methylphenyl)sulfonyl-3-phenyl-aziridin-2-yl]methanone

Systemtic Name: (4-bromophenyl)-[(2R,3S)-1-(4-methylphenyl)sulfonyl-3-phenyl-aziridin-2-yl]methanone Openeye Name: (4-bromophenyl)-[(2R,3S)-3-phenyl-1-(p-tolylsulfonyl)aziridin-2-yl]methanone CAS Name: (4-bromophenyl)-[(2R,3S)-1-(4-methylphenyl)sulfonyl-3-phenyl-2-aziridinyl]methanone IUPAC Name: (4-bromophenyl)-[(2R,3S)-1-(4-methylphenyl)sulfonyl-3-phenylaziridin-2-yl]methanone Traditional Name: (4-bromophenyl)-[(2R,3S)-3-phenyl-1-tosyl-ethylenimin-2-yl]methanone Formula: C22H18BrNO3S MolecularWeight: 456.35222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C2C(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@H]([C@@H]2C(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H18BrNO3S/c1-15-7-13-19(14-8-15)28(26,27)24-20(16-5-3-2-4-6-16)21(24)22(25)17-9-11-18(23)12-10-17/h2-14,20-21H,1H3/t20-,21+,24?/m0/s1