4-[6-[2-(4-bromanylphenoxy)ethoxy]pyridazin-3-yl]oxy-6-methyl-2-methylsulfanyl-pyrimidine

Systemtic Name: 4-[6-[2-(4-bromanylphenoxy)ethoxy]pyridazin-3-yl]oxy-6-methyl-2-methylsulfanyl-pyrimidine Openeye Name: 4-[6-[2-(4-bromophenoxy)ethoxy]pyridazin-3-yl]oxy-6-methyl-2-methylsulfanyl-pyrimidine CAS Name: 4-[[6-[2-(4-bromophenoxy)ethoxy]-3-pyridazinyl]oxy]-6-methyl-2-(methylthio)pyrimidine IUPAC Name: 4-[6-[2-(4-bromophenoxy)ethoxy]pyridazin-3-yl]oxy-6-methyl-2-methylsulfanylpyrimidine Traditional Name: 4-[6-[2-(4-bromophenoxy)ethoxy]pyridazin-3-yl]oxy-6-methyl-2-(methylthio)pyrimidine Formula: C18H17BrN4O3S MolecularWeight: 449.32158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC)OC2=NN=C(C=C2)OCCOC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=NC(=N1)SC)OC2=NN=C(C=C2)OCCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN4O3S/c1-12-11-17(21-18(20-12)27-2)26-16-8-7-15(22-23-16)25-10-9-24-14-5-3-13(19)4-6-14/h3-8,11H,9-10H2,1-2H3