2-(1-methylcyclopropyl)-N-[2-methyl-2-[[6-(propan-2-ylamino)pyridin-3-yl]carbonylamino]propyl]quinoline-4-carboxamide

Systemtic Name: 2-(1-methylcyclopropyl)-N-[2-methyl-2-[[6-(propan-2-ylamino)pyridin-3-yl]carbonylamino]propyl]quinoline-4-carboxamide Openeye Name: N-[2-[[6-(isopropylamino)pyridine-3-carbonyl]amino]-2-methyl-propyl]-2-(1-methylcyclopropyl)quinoline-4-carboxamide CAS Name: 2-(1-methylcyclopropyl)-N-[2-methyl-2-[[oxo-[6-(propan-2-ylamino)-3-pyridinyl]methyl]amino]propyl]-4-quinolinecarboxamide IUPAC Name: 2-(1-methylcyclopropyl)-N-[2-methyl-2-[[6-(propan-2-ylamino)pyridine-3-carbonyl]amino]propyl]quinoline-4-carboxamide Traditional Name: N-[2-[[6-(isopropylamino)nicotinoyl]amino]-2-methyl-propyl]-2-(1-methylcyclopropyl)cinchoninamide Formula: C27H33N5O2 MolecularWeight: 459.58322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=C(C=C1)C(=O)NC(C)(C)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4(CC4)C

Isomeric SMILES

CC(C)NC1=NC=C(C=C1)C(=O)NC(C)(C)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4(CC4)C

InChI

InChI=1S/C27H33N5O2/c1-17(2)30-23-11-10-18(15-28-23)24(33)32-26(3,4)16-29-25(34)20-14-22(27(5)12-13-27)31-21-9-7-6-8-19(20)21/h6-11,14-15,17H,12-13,16H2,1-5H3,(H,28,30)(H,29,34)(H,32,33)