[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]-2,2-dimethyl-cyclohexyl]-propyl-carbamic acid

Systemtic Name: [4-[[4-(dimethylamino)pyrimidin-2-yl]amino]-2,2-dimethyl-cyclohexyl]-propyl-carbamic acid Openeye Name: [4-[[4-(dimethylamino)pyrimidin-2-yl]amino]-2,2-dimethyl-cyclohexyl]-propyl-carbamic acid CAS Name: [4-[[4-(dimethylamino)-2-pyrimidinyl]amino]-2,2-dimethylcyclohexyl]-propylcarbamic acid IUPAC Name: [4-[[4-(dimethylamino)pyrimidin-2-yl]amino]-2,2-dimethylcyclohexyl]-propylcarbamic acid Traditional Name: [4-[[4-(dimethylamino)pyrimidin-2-yl]amino]-2,2-dimethyl-cyclohexyl]-propyl-carbamic acid Formula: C18H31N5O2 MolecularWeight: 349.47104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCC(CC1(C)C)NC2=NC=CC(=N2)N(C)C)C(=O)O

Isomeric SMILES

CCCN(C1CCC(CC1(C)C)NC2=NC=CC(=N2)N(C)C)C(=O)O

InChI

InChI=1S/C18H31N5O2/c1-6-11-23(17(24)25)14-8-7-13(12-18(14,2)3)20-16-19-10-9-15(21-16)22(4)5/h9-10,13-14H,6-8,11-12H2,1-5H3,(H,24,25)(H,19,20,21)