N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-3-ethyl-benzamide

Systemtic Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-3-ethyl-benzamide Openeye Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-3-ethyl-benzamide CAS Name: N-[4-[[6-(dimethylamino)-2-methyl-4-pyrimidinyl]amino]cyclohexyl]-3-ethylbenzamide IUPAC Name: N-[4-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]cyclohexyl]-3-ethylbenzamide Traditional Name: N-[4-[[6-(dimethylamino)-2-methyl-pyrimidin-4-yl]amino]cyclohexyl]-3-ethyl-benzamide Formula: C22H31N5O MolecularWeight: 381.51444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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