5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloranyl-2-methyl-pyridazin-3-one

Systemtic Name: 5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloranyl-2-methyl-pyridazin-3-one Openeye Name: 5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloro-2-methyl-pyridazin-3-one CAS Name: 5-[(4-tert-butylphenyl)methylthio]-4-chloro-2-methyl-3-pyridazinone IUPAC Name: 5-[(4-tert-butylphenyl)methylsulfanyl]-4-chloro-2-methylpyridazin-3-one Traditional Name: 5-[(4-tert-butylbenzyl)thio]-4-chloro-2-methyl-pyridazin-3-one Formula: C16H19ClN2OS MolecularWeight: 322.85286

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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)Cl

Isomeric SMILES

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

InChI

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