N2-(2,2-dimethyl-3H-1-benzofuran-7-yl)-N5-(1H-indol-4-ylmethyl)quinoline-2,5-diamine

Systemtic Name: N2-(2,2-dimethyl-3H-1-benzofuran-7-yl)-N5-(1H-indol-4-ylmethyl)quinoline-2,5-diamine Openeye Name: N2-(2,2-dimethyl-3H-benzofuran-7-yl)-N5-(1H-indol-4-ylmethyl)quinoline-2,5-diamine CAS Name: N2-(2,2-dimethyl-3H-benzofuran-7-yl)-N5-(1H-indol-4-ylmethyl)quinoline-2,5-diamine IUPAC Name: 2-N-(2,2-dimethyl-3H-1-benzofuran-7-yl)-5-N-(1H-indol-4-ylmethyl)quinoline-2,5-diamine Traditional Name: (2,2-dimethylcoumaran-7-yl)-[5-(1H-indol-4-ylmethylamino)-2-quinolyl]amine Formula: C28H26N4O MolecularWeight: 434.53224

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)NC3=NC4=C(C=C3)C(=CC=C4)NCC5=C6C=CNC6=CC=C5)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)NC3=NC4=C(C=C3)C(=CC=C4)NCC5=C6C=CNC6=CC=C5)C

InChI

InChI=1S/C28H26N4O/c1-28(2)16-18-6-3-11-25(27(18)33-28)32-26-13-12-21-23(9-5-10-24(21)31-26)30-17-19-7-4-8-22-20(19)14-15-29-22/h3-15,29-30H,16-17H2,1-2H3,(H,31,32)