N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-9H-xanthene-9-carboxamide Openeye Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-9H-xanthene-9-carboxamide CAS Name: N-[4-[[6-(dimethylamino)-2-methyl-4-pyrimidinyl]amino]cyclohexyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]cyclohexyl]-9H-xanthene-9-carboxamide Traditional Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-9H-xanthene-9-carboxamide Formula: C27H31N5O2 MolecularWeight: 457.56734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N(C)C)NC2CCC(CC2)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CC1=NC(=CC(=N1)N(C)C)NC2CCC(CC2)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C27H31N5O2/c1-17-28-24(16-25(29-17)32(2)3)30-18-12-14-19(15-13-18)31-27(33)26-20-8-4-6-10-22(20)34-23-11-7-5-9-21(23)26/h4-11,16,18-19,26H,12-15H2,1-3H3,(H,31,33)(H,28,29,30)