3-[3,5-bis(chloranyl)-4-methyl-phenyl]-5-prop-2-enylsulfanyl-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[3,5-bis(chloranyl)-4-methyl-phenyl]-5-prop-2-enylsulfanyl-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 5-allylsulfanyl-3-(3,5-dichloro-4-methyl-phenyl)-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-(3,5-dichloro-4-methylphenyl)-5-(prop-2-enylthio)-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-(3,5-dichloro-4-methylphenyl)-5-prop-2-enylsulfanyl-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 5-(allylthio)-3-(3,5-dichloro-4-methyl-phenyl)-4,5-dihydro-1H-pyridazin-6-one Formula: C14H14Cl2N2OS MolecularWeight: 329.24476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Cl)C2=NNC(=O)C(C2)SCC=C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1Cl)C2=NNC(=O)C(C2)SCC=C)Cl

InChI

InChI=1S/C14H14Cl2N2OS/c1-3-4-20-13-7-12(17-18-14(13)19)9-5-10(15)8(2)11(16)6-9/h3,5-6,13H,1,4,7H2,2H3,(H,18,19)