4-cyano-N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]benzamide

Systemtic Name: 4-cyano-N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]benzamide Openeye Name: 4-cyano-N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]benzamide CAS Name: 4-cyano-N-[4-[[6-(dimethylamino)-2-methyl-4-pyrimidinyl]amino]cyclohexyl]benzamide IUPAC Name: 4-cyano-N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]cyclohexyl]benzamide Traditional Name: 4-cyano-N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]benzamide Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N(C)C)NC2CCC(CC2)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=NC(=CC(=N1)N(C)C)NC2CCC(CC2)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H26N6O/c1-14-23-19(12-20(24-14)27(2)3)25-17-8-10-18(11-9-17)26-21(28)16-6-4-15(13-22)5-7-16/h4-7,12,17-18H,8-11H2,1-3H3,(H,26,28)(H,23,24,25)