2-[1,1-bis(chloranyl)-2-methyl-propan-2-yl]-5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloranyl-pyridazin-3-one

Systemtic Name: 2-[1,1-bis(chloranyl)-2-methyl-propan-2-yl]-5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloranyl-pyridazin-3-one Openeye Name: 5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloro-2-(2,2-dichloro-1,1-dimethyl-ethyl)pyridazin-3-one CAS Name: 5-[(4-tert-butylphenyl)methylthio]-4-chloro-2-(1,1-dichloro-2-methylpropan-2-yl)-3-pyridazinone IUPAC Name: 5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloro-2-(1,1-dichloro-2-methylpropan-2-yl)pyridazin-3-one Traditional Name: 5-[(4-tert-butylbenzyl)thio]-4-chloro-2-(2,2-dichloro-1,1-dimethyl-ethyl)pyridazin-3-one Formula: C19H23Cl3N2OS MolecularWeight: 433.82272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=C(C(=O)N(N=C2)C(C)(C)C(Cl)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=C(C(=O)N(N=C2)C(C)(C)C(Cl)Cl)Cl

InChI

InChI=1S/C19H23Cl3N2OS/c1-18(2,3)13-8-6-12(7-9-13)11-26-14-10-23-24(16(25)15(14)20)19(4,5)17(21)22/h6-10,17H,11H2,1-5H3