N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C18H16FN3O2S MolecularWeight: 357.401943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C2=NNC(=O)C3=CC=CC=C32)F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)C2=NNC(=O)C3=CC=CC=C32)F

InChI

InChI=1S/C18H16FN3O2S/c19-15-8-4-1-5-12(15)11-25-10-9-20-18(24)16-13-6-2-3-7-14(13)17(23)22-21-16/h1-8H,9-11H2,(H,20,24)(H,22,23)