5-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-3-(4-pentylcyclohexyl)-1,2,4-oxadiazole

Systemtic Name: 5-(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-3-(4-pentylcyclohexyl)-1,2,4-oxadiazole Openeye Name: 5-(5-chloro-2-methylsulfanyl-pyrimidin-4-yl)-3-(4-pentylcyclohexyl)-1,2,4-oxadiazole CAS Name: 5-[5-chloro-2-(methylthio)-4-pyrimidinyl]-3-(4-pentylcyclohexyl)-1,2,4-oxadiazole IUPAC Name: 5-(5-chloro-2-methylsulfanylpyrimidin-4-yl)-3-(4-pentylcyclohexyl)-1,2,4-oxadiazole Traditional Name: 3-(4-amylcyclohexyl)-5-[5-chloro-2-(methylthio)pyrimidin-4-yl]-1,2,4-oxadiazole Formula: C18H25ClN4OS MolecularWeight: 380.9353

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=NOC(=N2)C3=NC(=NC=C3Cl)SC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=NOC(=N2)C3=NC(=NC=C3Cl)SC

InChI

InChI=1S/C18H25ClN4OS/c1-3-4-5-6-12-7-9-13(10-8-12)16-22-17(24-23-16)15-14(19)11-20-18(21-15)25-2/h11-13H,3-10H2,1-2H3