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

Systemtic Name: N-[5-[[3-(2-cyanopropan-2-yl)phenyl]carbonylamino]-2-methyl-phenyl]-6-methyl-2-morpholin-4-yl-pyrimidine-4-carboxamide Openeye Name: N-[5-[[3-(1-cyano-1-methyl-ethyl)benzoyl]amino]-2-methyl-phenyl]-6-methyl-2-morpholino-pyrimidine-4-carboxamide CAS Name: N-[5-[[[3-(2-cyanopropan-2-yl)phenyl]-oxomethyl]amino]-2-methylphenyl]-6-methyl-2-(4-morpholinyl)-4-pyrimidinecarboxamide IUPAC Name: N-[5-[[3-(2-cyanopropan-2-yl)benzoyl]amino]-2-methylphenyl]-6-methyl-2-morpholin-4-ylpyrimidine-4-carboxamide Traditional Name: N-[5-[[3-(1-cyano-1-methyl-ethyl)benzoyl]amino]-2-methyl-phenyl]-6-methyl-2-morpholino-pyrimidine-4-carboxamide Formula: C28H30N6O3 MolecularWeight: 498.5762

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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=CC(=NC(=N3)N4CCOCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C(C)(C)C#N)NC(=O)C3=CC(=NC(=N3)N4CCOCC4)C

InChI

InChI=1S/C28H30N6O3/c1-18-8-9-22(31-25(35)20-6-5-7-21(15-20)28(3,4)17-29)16-23(18)32-26(36)24-14-19(2)30-27(33-24)34-10-12-37-13-11-34/h5-9,14-16H,10-13H2,1-4H3,(H,31,35)(H,32,36)