4-[6-(2-chloranyl-4-methylsulfanyl-phenoxy)hexyl]-3,5-diethyl-1H-pyrazole

Systemtic Name: 4-[6-(2-chloranyl-4-methylsulfanyl-phenoxy)hexyl]-3,5-diethyl-1H-pyrazole Openeye Name: 4-[6-(2-chloro-4-methylsulfanyl-phenoxy)hexyl]-3,5-diethyl-1H-pyrazole CAS Name: 4-[6-[2-chloro-4-(methylthio)phenoxy]hexyl]-3,5-diethyl-1H-pyrazole IUPAC Name: 4-[6-(2-chloro-4-methylsulfanylphenoxy)hexyl]-3,5-diethyl-1H-pyrazole Traditional Name: 4-[6-[2-chloro-4-(methylthio)phenoxy]hexyl]-3,5-diethyl-1H-pyrazole Formula: C20H29ClN2OS MolecularWeight: 380.97506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1)CC)CCCCCCOC2=C(C=C(C=C2)SC)Cl

Isomeric SMILES

CCC1=C(C(=NN1)CC)CCCCCCOC2=C(C=C(C=C2)SC)Cl

InChI

InChI=1S/C20H29ClN2OS/c1-4-18-16(19(5-2)23-22-18)10-8-6-7-9-13-24-20-12-11-15(25-3)14-17(20)21/h11-12,14H,4-10,13H2,1-3H3,(H,22,23)