N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[2-[bis(fluoranyl)methylsulfanyl]phenyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[2-(difluoromethylsulfanyl)phenyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[2-(difluoromethylthio)phenyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[2-(difluoromethylsulfanyl)phenyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-[2-(difluoromethylthio)phenyl]-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C19H17F2N3O2S MolecularWeight: 389.418986

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3SC(F)F

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3SC(F)F

InChI

InChI=1S/C19H17F2N3O2S/c1-2-11-24-18(26)13-8-4-3-7-12(13)16(23-24)17(25)22-14-9-5-6-10-15(14)27-19(20)21/h3-10,19H,2,11H2,1H3,(H,22,25)