(3Z)-6-(4-bromophenyl)sulfonyl-1-(4-methylphenyl)sulfonyl-2,5-dihydro-1,6-benzodiazocine

Systemtic Name: (3Z)-6-(4-bromophenyl)sulfonyl-1-(4-methylphenyl)sulfonyl-2,5-dihydro-1,6-benzodiazocine Openeye Name: (3Z)-6-(4-bromophenyl)sulfonyl-1-(p-tolylsulfonyl)-2,5-dihydro-1,6-benzodiazocine CAS Name: (3Z)-6-(4-bromophenyl)sulfonyl-1-(4-methylphenyl)sulfonyl-2,5-dihydro-1,6-benzodiazocine IUPAC Name: (3Z)-6-(4-bromophenyl)sulfonyl-1-(4-methylphenyl)sulfonyl-2,5-dihydro-1,6-benzodiazocine Traditional Name: (3Z)-6-brosyl-1-tosyl-2,5-dihydro-1,6-benzodiazocine Formula: C23H21BrN2O4S2 MolecularWeight: 533.45784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC=CCN(C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C/C=C\CN(C3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H21BrN2O4S2/c1-18-8-12-20(13-9-18)31(27,28)25-16-4-5-17-26(23-7-3-2-6-22(23)25)32(29,30)21-14-10-19(24)11-15-21/h2-15H,16-17H2,1H3/b5-4-