N-[2-[[(2S)-5-bromanylpenta-3,4-dien-2-yl]-(4-methylphenyl)sulfonyl-amino]ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[[(2S)-5-bromanylpenta-3,4-dien-2-yl]-(4-methylphenyl)sulfonyl-amino]ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-[[(1S)-4-bromo-1-methyl-buta-2,3-dienyl]-(p-tolylsulfonyl)amino]ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[[(2S)-5-bromopenta-3,4-dien-2-yl]-(4-methylphenyl)sulfonylamino]ethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[[(2S)-5-bromopenta-3,4-dien-2-yl]-(4-methylphenyl)sulfonylamino]ethyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[[(1S)-4-bromo-1-methyl-buta-2,3-dienyl]-tosyl-amino]ethyl]-4-methyl-benzenesulfonamide Formula: C21H25BrN2O4S2 MolecularWeight: 513.4682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCN(C(C)C=C=CBr)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCN([C@@H](C)C=C=CBr)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H25BrN2O4S2/c1-17-6-10-20(11-7-17)29(25,26)23-15-16-24(19(3)5-4-14-22)30(27,28)21-12-8-18(2)9-13-21/h5-14,19,23H,15-16H2,1-3H3/t4?,19-/m0/s1