1-(4-fluorophenyl)-4-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]phthalazine

Systemtic Name: 1-(4-fluorophenyl)-4-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]phthalazine Openeye Name: 1-(4-fluorophenyl)-4-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]phthalazine CAS Name: 1-(4-fluorophenyl)-4-[(2-methoxy-5-methylphenyl)methylthio]phthalazine IUPAC Name: 1-(4-fluorophenyl)-4-[(2-methoxy-5-methylphenyl)methylsulfanyl]phthalazine Traditional Name: 1-(4-fluorophenyl)-4-[(2-methoxy-5-methyl-benzyl)thio]phthalazine Formula: C23H19FN2OS MolecularWeight: 390.473163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H19FN2OS/c1-15-7-12-21(27-2)17(13-15)14-28-23-20-6-4-3-5-19(20)22(25-26-23)16-8-10-18(24)11-9-16/h3-13H,14H2,1-2H3