3-[3-(4-fluorophenyl)-4-(2-methylsulfanylpyrimidin-4-yl)pyrazol-1-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[3-(4-fluorophenyl)-4-(2-methylsulfanylpyrimidin-4-yl)pyrazol-1-yl]-1H-pyridazin-6-one Openeye Name: 3-[3-(4-fluorophenyl)-4-(2-methylsulfanylpyrimidin-4-yl)pyrazol-1-yl]-1H-pyridazin-6-one CAS Name: 3-[3-(4-fluorophenyl)-4-[2-(methylthio)-4-pyrimidinyl]-1-pyrazolyl]-1H-pyridazin-6-one IUPAC Name: 3-[3-(4-fluorophenyl)-4-(2-methylsulfanylpyrimidin-4-yl)pyrazol-1-yl]-1H-pyridazin-6-one Traditional Name: 3-[3-(4-fluorophenyl)-4-[2-(methylthio)pyrimidin-4-yl]pyrazol-1-yl]-1H-pyridazin-6-one Formula: C18H13FN6OS MolecularWeight: 380.398823

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C2=CN(N=C2C3=CC=C(C=C3)F)C4=NNC(=O)C=C4

Isomeric SMILES

CSC1=NC=CC(=N1)C2=CN(N=C2C3=CC=C(C=C3)F)C4=NNC(=O)C=C4

InChI

InChI=1S/C18H13FN6OS/c1-27-18-20-9-8-14(21-18)13-10-25(15-6-7-16(26)23-22-15)24-17(13)11-2-4-12(19)5-3-11/h2-10H,1H3,(H,23,26)