[(2R,3R)-3-(4-chlorophenyl)-1-(4-methylphenyl)sulfonyl-aziridin-2-yl]-piperidin-1-yl-methanone

Systemtic Name: [(2R,3R)-3-(4-chlorophenyl)-1-(4-methylphenyl)sulfonyl-aziridin-2-yl]-piperidin-1-yl-methanone Openeye Name: [(2R,3R)-3-(4-chlorophenyl)-1-(p-tolylsulfonyl)aziridin-2-yl]-(1-piperidyl)methanone CAS Name: [(2R,3R)-3-(4-chlorophenyl)-1-(4-methylphenyl)sulfonyl-2-aziridinyl]-(1-piperidinyl)methanone IUPAC Name: [(2R,3R)-3-(4-chlorophenyl)-1-(4-methylphenyl)sulfonylaziridin-2-yl]-piperidin-1-ylmethanone Traditional Name: [(2R,3R)-3-(4-chlorophenyl)-1-tosyl-ethylenimin-2-yl]-piperidino-methanone Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(C2C(=O)N3CCCCC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H]([C@@H]2C(=O)N3CCCCC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN2O3S/c1-15-5-11-18(12-6-15)28(26,27)24-19(16-7-9-17(22)10-8-16)20(24)21(25)23-13-3-2-4-14-23/h5-12,19-20H,2-4,13-14H2,1H3/t19-,20-,24?/m1/s1