N-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[(4-oxo-3H-phthalazin-1-yl)methyl]acetamide CAS Name: N-[(4-oxo-3H-phthalazin-1-yl)methyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[(4-oxo-3H-phthalazin-1-yl)methyl]acetamide Traditional Name: 2-(benzylthio)-N-[(4-keto-3H-phthalazin-1-yl)methyl]acetamide Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)NCC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)NCC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H17N3O2S/c22-17(12-24-11-13-6-2-1-3-7-13)19-10-16-14-8-4-5-9-15(14)18(23)21-20-16/h1-9H,10-12H2,(H,19,22)(H,21,23)