N-[4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]cyclohexyl]-3-ethyl-benzamide

Systemtic Name: N-[4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]cyclohexyl]-3-ethyl-benzamide Openeye Name: N-[4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]cyclohexyl]-3-ethyl-benzamide CAS Name: N-[4-[[4-(dimethylamino)-5-methyl-2-pyrimidinyl]amino]cyclohexyl]-3-ethylbenzamide IUPAC Name: N-[4-[[4-(dimethylamino)-5-methylpyrimidin-2-yl]amino]cyclohexyl]-3-ethylbenzamide Traditional Name: N-[4-[[4-(dimethylamino)-5-methyl-pyrimidin-2-yl]amino]cyclohexyl]-3-ethyl-benzamide Formula: C22H31N5O MolecularWeight: 381.51444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1)C(=O)NC2CCC(CC2)NC3=NC=C(C(=N3)N(C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1)C(=O)NC2CCC(CC2)NC3=NC=C(C(=N3)N(C)C)C

InChI

InChI=1S/C22H31N5O/c1-5-16-7-6-8-17(13-16)21(28)24-18-9-11-19(12-10-18)25-22-23-14-15(2)20(26-22)27(3)4/h6-8,13-14,18-19H,5,9-12H2,1-4H3,(H,24,28)(H,23,25,26)