1-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-phenyl-phthalazine

Systemtic Name: 1-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-phenyl-phthalazine Openeye Name: 1-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-4-phenyl-phthalazine CAS Name: 1-[(3-fluoro-4-methoxyphenyl)methylthio]-4-phenylphthalazine IUPAC Name: 1-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-4-phenylphthalazine Traditional Name: 1-[(3-fluoro-4-methoxy-benzyl)thio]-4-phenyl-phthalazine Formula: C22H17FN2OS MolecularWeight: 376.446583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)F

InChI

InChI=1S/C22H17FN2OS/c1-26-20-12-11-15(13-19(20)23)14-27-22-18-10-6-5-9-17(18)21(24-25-22)16-7-3-2-4-8-16/h2-13H,14H2,1H3