N-[5-[5-[(1,5-dimethylpyrazol-3-yl)amino]-6-oxidanylidene-1H-pyridazin-3-yl]-2-fluoranyl-phenyl]-4-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-[5-[(1,5-dimethylpyrazol-3-yl)amino]-6-oxidanylidene-1H-pyridazin-3-yl]-2-fluoranyl-phenyl]-4-methoxy-1-benzothiophene-2-carboxamide Openeye Name: N-[5-[5-[(1,5-dimethylpyrazol-3-yl)amino]-6-oxo-1H-pyridazin-3-yl]-2-fluoro-phenyl]-4-methoxy-benzothiophene-2-carboxamide CAS Name: N-[5-[5-[(1,5-dimethyl-3-pyrazolyl)amino]-6-oxo-1H-pyridazin-3-yl]-2-fluorophenyl]-4-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-[5-[(1,5-dimethylpyrazol-3-yl)amino]-6-oxo-1H-pyridazin-3-yl]-2-fluorophenyl]-4-methoxy-1-benzothiophene-2-carboxamide Traditional Name: N-[5-[5-[(1,5-dimethylpyrazol-3-yl)amino]-6-keto-1H-pyridazin-3-yl]-2-fluoro-phenyl]-4-methoxy-benzothiophene-2-carboxamide Formula: C25H21FN6O3S MolecularWeight: 504.536043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)NC2=CC(=NNC2=O)C3=CC(=C(C=C3)F)NC(=O)C4=CC5=C(C=CC=C5S4)OC

Isomeric SMILES

CC1=CC(=NN1C)NC2=CC(=NNC2=O)C3=CC(=C(C=C3)F)NC(=O)C4=CC5=C(C=CC=C5S4)OC

InChI

InChI=1S/C25H21FN6O3S/c1-13-9-23(31-32(13)2)27-19-12-17(29-30-24(19)33)14-7-8-16(26)18(10-14)28-25(34)22-11-15-20(35-3)5-4-6-21(15)36-22/h4-12H,1-3H3,(H,28,34)(H,30,33)(H,27,29,31)