1-[(3-chlorophenyl)methylsulfanyl]-5,8-bis(fluoranyl)-4-pyridin-2-yl-phthalazine

Systemtic Name: 1-[(3-chlorophenyl)methylsulfanyl]-5,8-bis(fluoranyl)-4-pyridin-2-yl-phthalazine Openeye Name: 1-[(3-chlorophenyl)methylsulfanyl]-5,8-difluoro-4-(2-pyridyl)phthalazine CAS Name: 1-[(3-chlorophenyl)methylthio]-5,8-difluoro-4-(2-pyridinyl)phthalazine IUPAC Name: 1-[(3-chlorophenyl)methylsulfanyl]-5,8-difluoro-4-pyridin-2-ylphthalazine Traditional Name: 1-[(3-chlorobenzyl)thio]-5,8-difluoro-4-(2-pyridyl)phthalazine Formula: C20H12ClF2N3S MolecularWeight: 399.844186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NN=C(C3=C(C=CC(=C32)F)F)SCC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=NC(=C1)C2=NN=C(C3=C(C=CC(=C32)F)F)SCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H12ClF2N3S/c21-13-5-3-4-12(10-13)11-27-20-18-15(23)8-7-14(22)17(18)19(25-26-20)16-6-1-2-9-24-16/h1-10H,11H2