N-[5-[(3-fluoranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxamide

Systemtic Name: N-[5-[(3-fluoranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxamide Openeye Name: N-[5-[(3-fluoro-4-methyl-phenyl)methyl]thiazol-2-yl]-6-oxo-1-phenyl-pyridazine-3-carboxamide CAS Name: N-[5-[(3-fluoro-4-methylphenyl)methyl]-2-thiazolyl]-6-oxo-1-phenyl-3-pyridazinecarboxamide IUPAC Name: N-[5-[(3-fluoro-4-methylphenyl)methyl]-1,3-thiazol-2-yl]-6-oxo-1-phenylpyridazine-3-carboxamide Traditional Name: N-[5-(3-fluoro-4-methyl-benzyl)thiazol-2-yl]-6-keto-1-phenyl-pyridazine-3-carboxamide Formula: C22H17FN4O2S MolecularWeight: 420.459383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C3=NN(C(=O)C=C3)C4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C3=NN(C(=O)C=C3)C4=CC=CC=C4)F

InChI

InChI=1S/C22H17FN4O2S/c1-14-7-8-15(12-18(14)23)11-17-13-24-22(30-17)25-21(29)19-9-10-20(28)27(26-19)16-5-3-2-4-6-16/h2-10,12-13H,11H2,1H3,(H,24,25,29)