N-[3-(4-fluorophenyl)sulfanylpropyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-[(4-fluorophenyl)thio]propyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[3-[(4-fluorophenyl)thio]propyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C19H18FN3O2S MolecularWeight: 371.428523

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCSC3=CC=C(C=C3)F

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCCSC3=CC=C(C=C3)F

InChI

InChI=1S/C19H18FN3O2S/c1-23-19(25)16-6-3-2-5-15(16)17(22-23)18(24)21-11-4-12-26-14-9-7-13(20)8-10-14/h2-3,5-10H,4,11-12H2,1H3,(H,21,24)