(2S,3S)-2-ethynyl-3-(phenylmethyl)-1-(2,4,6-trimethylphenyl)sulfonyl-aziridine

Systemtic Name: (2S,3S)-2-ethynyl-3-(phenylmethyl)-1-(2,4,6-trimethylphenyl)sulfonyl-aziridine Openeye Name: (2S,3S)-2-benzyl-3-ethynyl-1-(2,4,6-trimethylphenyl)sulfonyl-aziridine CAS Name: (2S,3S)-2-ethynyl-3-(phenylmethyl)-1-(2,4,6-trimethylphenyl)sulfonylaziridine IUPAC Name: (2S,3S)-2-benzyl-3-ethynyl-1-(2,4,6-trimethylphenyl)sulfonylaziridine Traditional Name: (2S,3S)-2-benzyl-3-ethynyl-1-mesitylsulfonyl-ethylenimine Formula: C20H21NO2S MolecularWeight: 339.45124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2C(C2C#C)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2[C@H]([C@@H]2C#C)CC3=CC=CC=C3)C

InChI

InChI=1S/C20H21NO2S/c1-5-18-19(13-17-9-7-6-8-10-17)21(18)24(22,23)20-15(3)11-14(2)12-16(20)4/h1,6-12,18-19H,13H2,2-4H3/t18-,19-,21?/m0/s1