N-[[1-(phenylsulfonyl)indol-3-yl]methyl]-N'-quinolin-2-yl-propane-1,3-diamine

Systemtic Name: N-[[1-(phenylsulfonyl)indol-3-yl]methyl]-N'-quinolin-2-yl-propane-1,3-diamine Openeye Name: N-[[1-(benzenesulfonyl)indol-3-yl]methyl]-N'-(2-quinolyl)propane-1,3-diamine CAS Name: N-[[1-(benzenesulfonyl)-3-indolyl]methyl]-N'-(2-quinolinyl)propane-1,3-diamine IUPAC Name: N-[[1-(benzenesulfonyl)indol-3-yl]methyl]-N'-quinolin-2-ylpropane-1,3-diamine Traditional Name: (1-besylindol-3-yl)methyl-[3-(2-quinolylamino)propyl]amine Formula: C27H26N4O2S MolecularWeight: 470.58594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CNCCCNC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)CNCCCNC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H26N4O2S/c32-34(33,23-10-2-1-3-11-23)31-20-22(24-12-5-7-14-26(24)31)19-28-17-8-18-29-27-16-15-21-9-4-6-13-25(21)30-27/h1-7,9-16,20,28H,8,17-19H2,(H,29,30)