6-(1-tert-butylcyclohexyl)-3-(5-pyrimidin-5-yl-1,2,4-oxadiazol-3-yl)hexanoate

Systemtic Name: 6-(1-tert-butylcyclohexyl)-3-(5-pyrimidin-5-yl-1,2,4-oxadiazol-3-yl)hexanoate Openeye Name: 6-(1-tert-butylcyclohexyl)-3-(5-pyrimidin-5-yl-1,2,4-oxadiazol-3-yl)hexanoate CAS Name: 6-(1-tert-butylcyclohexyl)-3-[5-(5-pyrimidinyl)-1,2,4-oxadiazol-3-yl]hexanoate IUPAC Name: 6-(1-tert-butylcyclohexyl)-3-(5-pyrimidin-5-yl-1,2,4-oxadiazol-3-yl)hexanoate Traditional Name: 6-(1-tert-butylcyclohexyl)-3-[5-(5-pyrimidyl)-1,2,4-oxadiazol-3-yl]hexanoate Formula: C22H31N4O3- MolecularWeight: 399.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CCCCC1)CCCC(CC(=O)[O-])C2=NOC(=N2)C3=CN=CN=C3

Isomeric SMILES

CC(C)(C)C1(CCCCC1)CCCC(CC(=O)[O-])C2=NOC(=N2)C3=CN=CN=C3

InChI

InChI=1S/C22H32N4O3/c1-21(2,3)22(9-5-4-6-10-22)11-7-8-16(12-18(27)28)19-25-20(29-26-19)17-13-23-15-24-14-17/h13-16H,4-12H2,1-3H3,(H,27,28)/p-1