3-[3-(4-aminocarbonylpyridin-2-yl)-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoate

Systemtic Name: 3-[3-(4-aminocarbonylpyridin-2-yl)-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoate Openeye Name: 3-[3-(4-carbamoyl-2-pyridyl)-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoate CAS Name: 3-[3-(4-carbamoyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-6-cyclohexylhexanoate IUPAC Name: 3-[3-(4-carbamoylpyridin-2-yl)-1,2,4-oxadiazol-5-yl]-6-cyclohexylhexanoate Traditional Name: 3-[3-(4-carbamoyl-2-pyridyl)-1,2,4-oxadiazol-5-yl]-6-cyclohexyl-hexanoate Formula: C20H25N4O4- MolecularWeight: 385.4369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCC(CC(=O)[O-])C2=NC(=NO2)C3=NC=CC(=C3)C(=O)N

Isomeric SMILES

C1CCC(CC1)CCCC(CC(=O)[O-])C2=NC(=NO2)C3=NC=CC(=C3)C(=O)N

InChI

InChI=1S/C20H26N4O4/c21-18(27)14-9-10-22-16(11-14)19-23-20(28-24-19)15(12-17(25)26)8-4-7-13-5-2-1-3-6-13/h9-11,13,15H,1-8,12H2,(H2,21,27)(H,25,26)/p-1