5-azanyl-4-methyl-2-(2-methylpropyl)-6-(4-methylsulfanylphenyl)pyridazin-3-one

Systemtic Name: 5-azanyl-4-methyl-2-(2-methylpropyl)-6-(4-methylsulfanylphenyl)pyridazin-3-one Openeye Name: 5-amino-2-isobutyl-4-methyl-6-(4-methylsulfanylphenyl)pyridazin-3-one CAS Name: 5-amino-4-methyl-2-(2-methylpropyl)-6-[4-(methylthio)phenyl]-3-pyridazinone IUPAC Name: 5-amino-4-methyl-2-(2-methylpropyl)-6-(4-methylsulfanylphenyl)pyridazin-3-one Traditional Name: 5-amino-2-isobutyl-4-methyl-6-[4-(methylthio)phenyl]pyridazin-3-one Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN(C1=O)CC(C)C)C2=CC=C(C=C2)SC)N

Isomeric SMILES

CC1=C(C(=NN(C1=O)CC(C)C)C2=CC=C(C=C2)SC)N

InChI

InChI=1S/C16H21N3OS/c1-10(2)9-19-16(20)11(3)14(17)15(18-19)12-5-7-13(21-4)8-6-12/h5-8,10H,9,17H2,1-4H3