6-(4-methylphenyl)-N-[6-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]pyridine-3-carboxamide

Systemtic Name: 6-(4-methylphenyl)-N-[6-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]pyridine-3-carboxamide Openeye Name: N-[6-methyl-3-(pyrrolidin-1-ylmethyl)-7-quinolyl]-6-(p-tolyl)pyridine-3-carboxamide CAS Name: 6-(4-methylphenyl)-N-[6-methyl-3-(1-pyrrolidinylmethyl)-7-quinolinyl]-3-pyridinecarboxamide IUPAC Name: 6-(4-methylphenyl)-N-[6-methyl-3-(pyrrolidin-1-ylmethyl)quinolin-7-yl]pyridine-3-carboxamide Traditional Name: N-[6-methyl-3-(pyrrolidinomethyl)-7-quinolyl]-6-(p-tolyl)nicotinamide Formula: C28H28N4O MolecularWeight: 436.54812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC=C(C=C2)C(=O)NC3=CC4=NC=C(C=C4C=C3C)CN5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC=C(C=C2)C(=O)NC3=CC4=NC=C(C=C4C=C3C)CN5CCCC5

InChI

InChI=1S/C28H28N4O/c1-19-5-7-22(8-6-19)25-10-9-23(17-30-25)28(33)31-26-15-27-24(13-20(26)2)14-21(16-29-27)18-32-11-3-4-12-32/h5-10,13-17H,3-4,11-12,18H2,1-2H3,(H,31,33)