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

Systemtic Name: 4-butyl-2-tert-butyl-5-[(4-tert-butylphenyl)methylsulfanyl]pyridazin-3-one Openeye Name: 4-butyl-2-tert-butyl-5-[(4-tert-butylphenyl)methylsulfanyl]pyridazin-3-one CAS Name: 4-butyl-2-tert-butyl-5-[(4-tert-butylphenyl)methylthio]-3-pyridazinone IUPAC Name: 4-butyl-2-tert-butyl-5-[(4-tert-butylphenyl)methylsulfanyl]pyridazin-3-one Traditional Name: 4-butyl-2-tert-butyl-5-[(4-tert-butylbenzyl)thio]pyridazin-3-one Formula: C23H34N2OS MolecularWeight: 386.59386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=NN(C1=O)C(C)(C)C)SCC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCC1=C(C=NN(C1=O)C(C)(C)C)SCC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C23H34N2OS/c1-8-9-10-19-20(15-24-25(21(19)26)23(5,6)7)27-16-17-11-13-18(14-12-17)22(2,3)4/h11-15H,8-10,16H2,1-7H3