5-[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]-1,3,4-oxadiazole-2-thiolate

Systemtic Name: 5-[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]-1,3,4-oxadiazole-2-thiolate Openeye Name: 5-(3-benzyl-4-oxo-phthalazin-1-yl)-1,3,4-oxadiazole-2-thiolate CAS Name: 5-[4-oxo-3-(phenylmethyl)-1-phthalazinyl]-1,3,4-oxadiazole-2-thiolate IUPAC Name: 5-(3-benzyl-4-oxophthalazin-1-yl)-1,3,4-oxadiazole-2-thiolate Traditional Name: 5-(3-benzyl-4-keto-phthalazin-1-yl)-1,3,4-oxadiazole-2-thiolate Formula: C17H11N4O2S- MolecularWeight: 335.35984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C4=NN=C(O4)[S-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3C(=N2)C4=NN=C(O4)[S-]

InChI

InChI=1S/C17H12N4O2S/c22-16-13-9-5-4-8-12(13)14(15-18-19-17(24)23-15)20-21(16)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,19,24)/p-1