6-(3,5-dimethylpyrazol-1-yl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide

Systemtic Name: 6-(3,5-dimethylpyrazol-1-yl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide Openeye Name: 6-(3,5-dimethylpyrazol-1-yl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide CAS Name: 6-(3,5-dimethyl-1-pyrazolyl)-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 6-(3,5-dimethylpyrazol-1-yl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 6-(3,5-dimethylpyrazol-1-yl)-N-[3-(isobutyrylamino)benzyl]nicotinamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC=C(C=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C)C

Isomeric SMILES

CC1=CC(=NN1C2=NC=C(C=C2)C(=O)NCC3=CC(=CC=C3)NC(=O)C(C)C)C

InChI

InChI=1S/C22H25N5O2/c1-14(2)21(28)25-19-7-5-6-17(11-19)12-24-22(29)18-8-9-20(23-13-18)27-16(4)10-15(3)26-27/h5-11,13-14H,12H2,1-4H3,(H,24,29)(H,25,28)