N-[(1R,2R)-3-(chloromethyl)-1-phenyl-2-(phenylsulfonyl)but-3-enyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1R,2R)-3-(chloromethyl)-1-phenyl-2-(phenylsulfonyl)but-3-enyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R,2R)-2-(benzenesulfonyl)-3-(chloromethyl)-1-phenyl-but-3-enyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1R,2R)-2-(benzenesulfonyl)-3-(chloromethyl)-1-phenylbut-3-enyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1R,2R)-2-(benzenesulfonyl)-3-(chloromethyl)-1-phenylbut-3-enyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R,2R)-2-besyl-3-(chloromethyl)-1-phenyl-but-3-enyl]-4-methyl-benzenesulfonamide Formula: C24H24ClNO4S2 MolecularWeight: 490.03466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(C(=C)CCl)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C2=CC=CC=C2)[C@@H](C(=C)CCl)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H24ClNO4S2/c1-18-13-15-22(16-14-18)32(29,30)26-23(20-9-5-3-6-10-20)24(19(2)17-25)31(27,28)21-11-7-4-8-12-21/h3-16,23-24,26H,2,17H2,1H3/t23-,24-/m1/s1