2-methylsulfanyl-N-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]benzamide

Systemtic Name: 2-methylsulfanyl-N-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]benzamide Openeye Name: 2-methylsulfanyl-N-[(4-oxo-3H-phthalazin-1-yl)methyl]benzamide CAS Name: 2-(methylthio)-N-[(4-oxo-3H-phthalazin-1-yl)methyl]benzamide IUPAC Name: 2-methylsulfanyl-N-[(4-oxo-3H-phthalazin-1-yl)methyl]benzamide Traditional Name: N-[(4-keto-3H-phthalazin-1-yl)methyl]-2-(methylthio)benzamide Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)NCC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CSC1=CC=CC=C1C(=O)NCC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H15N3O2S/c1-23-15-9-5-4-8-13(15)16(21)18-10-14-11-6-2-3-7-12(11)17(22)20-19-14/h2-9H,10H2,1H3,(H,18,21)(H,20,22)