2-tert-butyl-4-chloranyl-5-[(2-methylphenyl)methylsulfanyl]pyridazin-3-one

Systemtic Name: 2-tert-butyl-4-chloranyl-5-[(2-methylphenyl)methylsulfanyl]pyridazin-3-one Openeye Name: 2-tert-butyl-4-chloro-5-(o-tolylmethylsulfanyl)pyridazin-3-one CAS Name: 2-tert-butyl-4-chloro-5-[(2-methylphenyl)methylthio]-3-pyridazinone IUPAC Name: 2-tert-butyl-4-chloro-5-[(2-methylphenyl)methylsulfanyl]pyridazin-3-one Traditional Name: 2-tert-butyl-4-chloro-5-[(2-methylbenzyl)thio]pyridazin-3-one Formula: C16H19ClN2OS MolecularWeight: 322.85286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=C(C(=O)N(N=C2)C(C)(C)C)Cl

Isomeric SMILES

CC1=CC=CC=C1CSC2=C(C(=O)N(N=C2)C(C)(C)C)Cl

InChI

InChI=1S/C16H19ClN2OS/c1-11-7-5-6-8-12(11)10-21-13-9-18-19(16(2,3)4)15(20)14(13)17/h5-9H,10H2,1-4H3