N-[(2-bromophenyl)methyl]-N-[[1-(4-methylphenyl)sulfonylindol-2-yl]methyl]butan-1-amine

Systemtic Name: N-[(2-bromophenyl)methyl]-N-[[1-(4-methylphenyl)sulfonylindol-2-yl]methyl]butan-1-amine Openeye Name: N-[(2-bromophenyl)methyl]-N-[[1-(p-tolylsulfonyl)indol-2-yl]methyl]butan-1-amine CAS Name: N-[(2-bromophenyl)methyl]-N-[[1-(4-methylphenyl)sulfonyl-2-indolyl]methyl]-1-butanamine IUPAC Name: N-[(2-bromophenyl)methyl]-N-[[1-(4-methylphenyl)sulfonylindol-2-yl]methyl]butan-1-amine Traditional Name: (2-bromobenzyl)-butyl-[(1-tosylindol-2-yl)methyl]amine Formula: C27H29BrN2O2S MolecularWeight: 525.50036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1Br)CC2=CC3=CC=CC=C3N2S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCN(CC1=CC=CC=C1Br)CC2=CC3=CC=CC=C3N2S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H29BrN2O2S/c1-3-4-17-29(19-23-10-5-7-11-26(23)28)20-24-18-22-9-6-8-12-27(22)30(24)33(31,32)25-15-13-21(2)14-16-25/h5-16,18H,3-4,17,19-20H2,1-2H3