N-[3-[[3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[3-[[3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]phenyl]pyridine-4-carboxamide Openeye Name: N-[3-[[3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]phenyl]pyridine-4-carboxamide CAS Name: N-[3-[[3-methyl-2-[(3-methyl-1-oxobutyl)amino]-1-oxobutyl]amino]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[3-[[3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]phenyl]pyridine-4-carboxamide Traditional Name: N-[3-[[2-(isovalerylamino)-3-methyl-butanoyl]amino]phenyl]isonicotinamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(C(C)C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=NC=C2

Isomeric SMILES

CC(C)CC(=O)NC(C(C)C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=NC=C2

InChI

InChI=1S/C22H28N4O3/c1-14(2)12-19(27)26-20(15(3)4)22(29)25-18-7-5-6-17(13-18)24-21(28)16-8-10-23-11-9-16/h5-11,13-15,20H,12H2,1-4H3,(H,24,28)(H,25,29)(H,26,27)