3-methyl-4-oxidanylidene-N-[2-(phenylmethylsulfanyl)ethyl]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[2-(phenylmethylsulfanyl)ethyl]phthalazine-1-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[2-(phenylmethylthio)ethyl]-1-phthalazinecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O2S/c1-22-19(24)16-10-6-5-9-15(16)17(21-22)18(23)20-11-12-25-13-14-7-3-2-4-8-14/h2-10H,11-13H2,1H3,(H,20,23)