N-(2-bromanylprop-2-enyl)-N-[[5-methyl-1-(4-methylphenyl)sulfonyl-indol-2-yl]methyl]butan-1-amine

Systemtic Name: N-(2-bromanylprop-2-enyl)-N-[[5-methyl-1-(4-methylphenyl)sulfonyl-indol-2-yl]methyl]butan-1-amine Openeye Name: N-(2-bromoallyl)-N-[[5-methyl-1-(p-tolylsulfonyl)indol-2-yl]methyl]butan-1-amine CAS Name: N-(2-bromoprop-2-enyl)-N-[[5-methyl-1-(4-methylphenyl)sulfonyl-2-indolyl]methyl]-1-butanamine IUPAC Name: N-(2-bromoprop-2-enyl)-N-[[5-methyl-1-(4-methylphenyl)sulfonylindol-2-yl]methyl]butan-1-amine Traditional Name: 2-bromoallyl-butyl-[(5-methyl-1-tosyl-indol-2-yl)methyl]amine Formula: C24H29BrN2O2S MolecularWeight: 489.46826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC2=C(N1S(=O)(=O)C3=CC=C(C=C3)C)C=CC(=C2)C)CC(=C)Br

Isomeric SMILES

CCCCN(CC1=CC2=C(N1S(=O)(=O)C3=CC=C(C=C3)C)C=CC(=C2)C)CC(=C)Br

InChI

InChI=1S/C24H29BrN2O2S/c1-5-6-13-26(16-20(4)25)17-22-15-21-14-19(3)9-12-24(21)27(22)30(28,29)23-10-7-18(2)8-11-23/h7-12,14-15H,4-6,13,16-17H2,1-3H3