N-[5-[[3-(2-cyanopropan-2-yl)phenyl]carbonylamino]-2-methyl-phenyl]-6-morpholin-4-yl-pyridine-2-carboxamide

Systemtic Name: N-[5-[[3-(2-cyanopropan-2-yl)phenyl]carbonylamino]-2-methyl-phenyl]-6-morpholin-4-yl-pyridine-2-carboxamide Openeye Name: N-[5-[[3-(1-cyano-1-methyl-ethyl)benzoyl]amino]-2-methyl-phenyl]-6-morpholino-pyridine-2-carboxamide CAS Name: N-[5-[[[3-(2-cyanopropan-2-yl)phenyl]-oxomethyl]amino]-2-methylphenyl]-6-(4-morpholinyl)-2-pyridinecarboxamide IUPAC Name: N-[5-[[3-(2-cyanopropan-2-yl)benzoyl]amino]-2-methylphenyl]-6-morpholin-4-ylpyridine-2-carboxamide Traditional Name: N-[5-[[3-(1-cyano-1-methyl-ethyl)benzoyl]amino]-2-methyl-phenyl]-6-morpholino-picolinamide Formula: C28H29N5O3 MolecularWeight: 483.56156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#N)NC(=O)C3=NC(=CC=C3)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#N)NC(=O)C3=NC(=CC=C3)N4CCOCC4

InChI

InChI=1S/C28H29N5O3/c1-19-10-11-22(30-26(34)20-6-4-7-21(16-20)28(2,3)18-29)17-24(19)32-27(35)23-8-5-9-25(31-23)33-12-14-36-15-13-33/h4-11,16-17H,12-15H2,1-3H3,(H,30,34)(H,32,35)