2-methyl-4-methylsulfanyl-5-pent-1-ynyl-pyridazin-3-one

Systemtic Name: 2-methyl-4-methylsulfanyl-5-pent-1-ynyl-pyridazin-3-one Openeye Name: 2-methyl-4-methylsulfanyl-5-pent-1-ynyl-pyridazin-3-one CAS Name: 2-methyl-4-(methylthio)-5-pent-1-ynyl-3-pyridazinone IUPAC Name: 2-methyl-4-methylsulfanyl-5-pent-1-ynylpyridazin-3-one Traditional Name: 2-methyl-4-(methylthio)-5-pent-1-ynyl-pyridazin-3-one Formula: C11H14N2OS MolecularWeight: 222.30666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC1=C(C(=O)N(N=C1)C)SC

Isomeric SMILES

CCCC#CC1=C(C(=O)N(N=C1)C)SC

InChI

InChI=1S/C11H14N2OS/c1-4-5-6-7-9-8-12-13(2)11(14)10(9)15-3/h8H,4-5H2,1-3H3