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

Systemtic Name: 2-tert-butyl-4-chloranyl-5-[1-(4-phenylphenyl)ethylsulfanyl]pyridazin-3-one Openeye Name: 2-tert-butyl-4-chloro-5-[1-(4-phenylphenyl)ethylsulfanyl]pyridazin-3-one CAS Name: 2-tert-butyl-4-chloro-5-[1-(4-phenylphenyl)ethylthio]-3-pyridazinone IUPAC Name: 2-tert-butyl-4-chloro-5-[1-(4-phenylphenyl)ethylsulfanyl]pyridazin-3-one Traditional Name: 2-tert-butyl-4-chloro-5-[1-(4-phenylphenyl)ethylthio]pyridazin-3-one Formula: C22H23ClN2OS MolecularWeight: 398.94882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC=CC=C2)SC3=C(C(=O)N(N=C3)C(C)(C)C)Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=CC=CC=C2)SC3=C(C(=O)N(N=C3)C(C)(C)C)Cl

InChI

InChI=1S/C22H23ClN2OS/c1-15(16-10-12-18(13-11-16)17-8-6-5-7-9-17)27-19-14-24-25(22(2,3)4)21(26)20(19)23/h5-15H,1-4H3