(2R,3S)-2-(2-bromophenyl)-3-hex-1-ynyl-1-(4-methylphenyl)sulfonyl-aziridine

Systemtic Name: (2R,3S)-2-(2-bromophenyl)-3-hex-1-ynyl-1-(4-methylphenyl)sulfonyl-aziridine Openeye Name: (2R,3S)-2-(2-bromophenyl)-3-hex-1-ynyl-1-(p-tolylsulfonyl)aziridine CAS Name: (2R,3S)-2-(2-bromophenyl)-3-hex-1-ynyl-1-(4-methylphenyl)sulfonylaziridine IUPAC Name: (2R,3S)-2-(2-bromophenyl)-3-hex-1-ynyl-1-(4-methylphenyl)sulfonylaziridine Traditional Name: (2R,3S)-2-(2-bromophenyl)-3-hex-1-ynyl-1-tosyl-ethylenimine Formula: C21H22BrNO2S MolecularWeight: 432.37388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1C(N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3Br

Isomeric SMILES

CCCCC#C[C@H]1[C@H](N1S(=O)(=O)C2=CC=C(C=C2)C)C3=CC=CC=C3Br

InChI

InChI=1S/C21H22BrNO2S/c1-3-4-5-6-11-20-21(18-9-7-8-10-19(18)22)23(20)26(24,25)17-14-12-16(2)13-15-17/h7-10,12-15,20-21H,3-5H2,1-2H3/t20-,21+,23?/m0/s1