3-[(3,5-dimethyl-1-benzofuran-2-yl)sulfanyl]-1H-pyridazin-6-one

Systemtic Name: 3-[(3,5-dimethyl-1-benzofuran-2-yl)sulfanyl]-1H-pyridazin-6-one Openeye Name: 3-(3,5-dimethylbenzofuran-2-yl)sulfanyl-1H-pyridazin-6-one CAS Name: 3-[(3,5-dimethyl-2-benzofuranyl)thio]-1H-pyridazin-6-one IUPAC Name: 3-[(3,5-dimethyl-1-benzofuran-2-yl)sulfanyl]-1H-pyridazin-6-one Traditional Name: 3-[(3,5-dimethylbenzofuran-2-yl)thio]-1H-pyridazin-6-one Formula: C14H12N2O2S MolecularWeight: 272.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C2C)SC3=NNC(=O)C=C3

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C2C)SC3=NNC(=O)C=C3

InChI

InChI=1S/C14H12N2O2S/c1-8-3-4-11-10(7-8)9(2)14(18-11)19-13-6-5-12(17)15-16-13/h3-7H,1-2H3,(H,15,17)