2-tert-butyl-4-(3-methylbutoxy)-5-(4-methylsulfanylphenyl)pyridazin-3-one

Systemtic Name: 2-tert-butyl-4-(3-methylbutoxy)-5-(4-methylsulfanylphenyl)pyridazin-3-one Openeye Name: 2-tert-butyl-4-isopentyloxy-5-(4-methylsulfanylphenyl)pyridazin-3-one CAS Name: 2-tert-butyl-4-(3-methylbutoxy)-5-[4-(methylthio)phenyl]-3-pyridazinone IUPAC Name: 2-tert-butyl-4-(3-methylbutoxy)-5-(4-methylsulfanylphenyl)pyridazin-3-one Traditional Name: 2-tert-butyl-4-isoamoxy-5-[4-(methylthio)phenyl]pyridazin-3-one Formula: C20H28N2O2S MolecularWeight: 360.51352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=NN(C1=O)C(C)(C)C)C2=CC=C(C=C2)SC

Isomeric SMILES

CC(C)CCOC1=C(C=NN(C1=O)C(C)(C)C)C2=CC=C(C=C2)SC

InChI

InChI=1S/C20H28N2O2S/c1-14(2)11-12-24-18-17(15-7-9-16(25-6)10-8-15)13-21-22(19(18)23)20(3,4)5/h7-10,13-14H,11-12H2,1-6H3