2-[[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[4-(4-fluorophenyl)-1-phthalazinyl]thio]methyl]benzonitrile IUPAC Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[4-(4-fluorophenyl)phthalazin-1-yl]thio]methyl]benzonitrile Formula: C22H14FN3S MolecularWeight: 371.430063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H14FN3S/c23-18-11-9-15(10-12-18)21-19-7-3-4-8-20(19)22(26-25-21)27-14-17-6-2-1-5-16(17)13-24/h1-12H,14H2