(2S,3R)-3-cyclohexyl-N,N-dimethyl-1-(4-methylphenyl)sulfonyl-aziridine-2-carboxamide

Systemtic Name: (2S,3R)-3-cyclohexyl-N,N-dimethyl-1-(4-methylphenyl)sulfonyl-aziridine-2-carboxamide Openeye Name: (2S,3R)-3-cyclohexyl-N,N-dimethyl-1-(p-tolylsulfonyl)aziridine-2-carboxamide CAS Name: (2S,3R)-3-cyclohexyl-N,N-dimethyl-1-(4-methylphenyl)sulfonyl-2-aziridinecarboxamide IUPAC Name: (2S,3R)-3-cyclohexyl-N,N-dimethyl-1-(4-methylphenyl)sulfonylaziridine-2-carboxamide Traditional Name: (2S,3R)-3-cyclohexyl-N,N-dimethyl-1-tosyl-ethylenimine-2-carboxamide Formula: C18H26N2O3S MolecularWeight: 350.47564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C2C(=O)N(C)C)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H]([C@H]2C(=O)N(C)C)C3CCCCC3

InChI

InChI=1S/C18H26N2O3S/c1-13-9-11-15(12-10-13)24(22,23)20-16(14-7-5-4-6-8-14)17(20)18(21)19(2)3/h9-12,14,16-17H,4-8H2,1-3H3/t16-,17+,20?/m1/s1