2-tert-butyl-5-[1-(4-tert-butylphenyl)ethylsulfanyl]-4-chloranyl-pyridazin-3-one

Systemtic Name: 2-tert-butyl-5-[1-(4-tert-butylphenyl)ethylsulfanyl]-4-chloranyl-pyridazin-3-one Openeye Name: 2-tert-butyl-5-[1-(4-tert-butylphenyl)ethylsulfanyl]-4-chloro-pyridazin-3-one CAS Name: 2-tert-butyl-5-[1-(4-tert-butylphenyl)ethylthio]-4-chloro-3-pyridazinone IUPAC Name: 2-tert-butyl-5-[1-(4-tert-butylphenyl)ethylsulfanyl]-4-chloropyridazin-3-one Traditional Name: 2-tert-butyl-5-[1-(4-tert-butylphenyl)ethylthio]-4-chloro-pyridazin-3-one Formula: C20H27ClN2OS MolecularWeight: 378.95918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(C)(C)C)SC2=C(C(=O)N(N=C2)C(C)(C)C)Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)C(C)(C)C)SC2=C(C(=O)N(N=C2)C(C)(C)C)Cl

InChI

InChI=1S/C20H27ClN2OS/c1-13(14-8-10-15(11-9-14)19(2,3)4)25-16-12-22-23(20(5,6)7)18(24)17(16)21/h8-13H,1-7H3