N-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[4-(3-fluoro-4-methoxyphenyl)-2-thiazolyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C25H17FN4O3S MolecularWeight: 472.490883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5)F

InChI

InChI=1S/C25H17FN4O3S/c1-33-21-12-11-15(13-19(21)26)20-14-34-25(27-20)28-23(31)22-17-9-5-6-10-18(17)24(32)30(29-22)16-7-3-2-4-8-16/h2-14H,1H3,(H,27,28,31)