N-[3-(4-fluorophenyl)sulfanylpropyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[3-[(4-fluorophenyl)thio]propyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[3-[(4-fluorophenyl)thio]propyl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C24H20FN3O2S MolecularWeight: 433.497903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCCCSC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCCCSC4=CC=C(C=C4)F

InChI

InChI=1S/C24H20FN3O2S/c25-17-11-13-19(14-12-17)31-16-6-15-26-23(29)22-20-9-4-5-10-21(20)24(30)28(27-22)18-7-2-1-3-8-18/h1-5,7-14H,6,15-16H2,(H,26,29)