methyl 2-[6-(3-chloranylpropylsulfanyl)imidazo[1,2-b]pyridazin-2-yl]-2-methyl-propanoate

Systemtic Name: methyl 2-[6-(3-chloranylpropylsulfanyl)imidazo[1,2-b]pyridazin-2-yl]-2-methyl-propanoate Openeye Name: methyl 2-[6-(3-chloropropylsulfanyl)imidazo[1,2-b]pyridazin-2-yl]-2-methyl-propanoate CAS Name: 2-[6-(3-chloropropylthio)-2-imidazo[1,2-b]pyridazinyl]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[6-(3-chloropropylsulfanyl)imidazo[1,2-b]pyridazin-2-yl]-2-methylpropanoate Traditional Name: 2-[6-(3-chloropropylthio)imidazo[1,2-b]pyridazin-2-yl]-2-methyl-propionic acid methyl ester Formula: C14H18ClN3O2S MolecularWeight: 327.82962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CN2C(=N1)C=CC(=N2)SCCCCl)C(=O)OC

Isomeric SMILES

CC(C)(C1=CN2C(=N1)C=CC(=N2)SCCCCl)C(=O)OC

InChI

InChI=1S/C14H18ClN3O2S/c1-14(2,13(19)20-3)10-9-18-11(16-10)5-6-12(17-18)21-8-4-7-15/h5-6,9H,4,7-8H2,1-3H3