2-[(3-fluorophenyl)methyl]-6-methyl-1-(3-morpholin-4-ylpropyl)-4-oxidanylidene-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 2-[(3-fluorophenyl)methyl]-6-methyl-1-(3-morpholin-4-ylpropyl)-4-oxidanylidene-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-[(3-fluorophenyl)methyl]-6-methyl-1-(3-morpholinopropyl)-4-oxo-N-(4-pyridylmethyl)pyridine-3-carboxamide CAS Name: 2-[(3-fluorophenyl)methyl]-6-methyl-1-[3-(4-morpholinyl)propyl]-4-oxo-N-(pyridin-4-ylmethyl)-3-pyridinecarboxamide IUPAC Name: 2-[(3-fluorophenyl)methyl]-6-methyl-1-(3-morpholin-4-ylpropyl)-4-oxo-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide Traditional Name: 2-(3-fluorobenzyl)-4-keto-6-methyl-1-(3-morpholinopropyl)-N-(4-pyridylmethyl)nicotinamide Formula: C27H31FN4O3 MolecularWeight: 478.558443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(N1CCCN2CCOCC2)CC3=CC(=CC=C3)F)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CC1=CC(=O)C(=C(N1CCCN2CCOCC2)CC3=CC(=CC=C3)F)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C27H31FN4O3/c1-20-16-25(33)26(27(34)30-19-21-6-8-29-9-7-21)24(18-22-4-2-5-23(28)17-22)32(20)11-3-10-31-12-14-35-15-13-31/h2,4-9,16-17H,3,10-15,18-19H2,1H3,(H,30,34)