1-(1,3-benzothiazol-2-yl)-4-oxidanylidene-7-(phenylmethylidene)-5,6-dihydrocyclopenta[c]pyridazin-3-olate

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-4-oxidanylidene-7-(phenylmethylidene)-5,6-dihydrocyclopenta[c]pyridazin-3-olate Openeye Name: 1-(1,3-benzothiazol-2-yl)-7-benzylidene-4-oxo-5,6-dihydrocyclopenta[c]pyridazin-3-olate CAS Name: 1-(1,3-benzothiazol-2-yl)-4-oxo-7-(phenylmethylene)-5,6-dihydrocyclopenta[c]pyridazin-3-olate IUPAC Name: 1-(1,3-benzothiazol-2-yl)-7-benzylidene-4-oxo-5,6-dihydrocyclopenta[c]pyridazin-3-olate Traditional Name: 7-benzal-1-(1,3-benzothiazol-2-yl)-4-keto-5,6-dihydrocyclopenta[c]pyridazin-3-olate Formula: C21H14N3O2S- MolecularWeight: 372.41976

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1=CC3=CC=CC=C3)N(N=C(C2=O)[O-])C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC2=C(C1=CC3=CC=CC=C3)N(N=C(C2=O)[O-])C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H15N3O2S/c25-19-15-11-10-14(12-13-6-2-1-3-7-13)18(15)24(23-20(19)26)21-22-16-8-4-5-9-17(16)27-21/h1-9,12H,10-11H2,(H,23,26)/p-1