N-[[3-(2-methylpropanoylamino)phenyl]methyl]-6-morpholin-4-yl-pyridine-3-carboxamide

Systemtic Name: N-[[3-(2-methylpropanoylamino)phenyl]methyl]-6-morpholin-4-yl-pyridine-3-carboxamide Openeye Name: N-[[3-(2-methylpropanoylamino)phenyl]methyl]-6-morpholino-pyridine-3-carboxamide CAS Name: N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-6-(4-morpholinyl)-3-pyridinecarboxamide IUPAC Name: N-[[3-(2-methylpropanoylamino)phenyl]methyl]-6-morpholin-4-ylpyridine-3-carboxamide Traditional Name: N-[3-(isobutyrylamino)benzyl]-6-morpholino-nicotinamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CN=C(C=C2)N3CCOCC3

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CN=C(C=C2)N3CCOCC3

InChI

InChI=1S/C21H26N4O3/c1-15(2)20(26)24-18-5-3-4-16(12-18)13-23-21(27)17-6-7-19(22-14-17)25-8-10-28-11-9-25/h3-7,12,14-15H,8-11,13H2,1-2H3,(H,23,27)(H,24,26)