2,5-diphenyl-3aH-[1,3]dithiolo[4,5-d]pyridazin-5-ium-4-one

Systemtic Name: 2,5-diphenyl-3aH-[1,3]dithiolo[4,5-d]pyridazin-5-ium-4-one Openeye Name: 2,5-diphenyl-3aH-[1,3]dithiolo[4,5-d]pyridazin-5-ium-4-one CAS Name: 2,5-diphenyl-3aH-[1,3]dithiolo[4,5-d]pyridazin-5-ium-4-one IUPAC Name: 2,5-diphenyl-3aH-[1,3]dithiolo[4,5-d]pyridazin-5-ium-4-one Traditional Name: 2,5-diphenyl-3aH-[1,3]dithiolo[4,5-d]pyridazin-5-ium-4-one Formula: C17H13N2OS2+ MolecularWeight: 325.42792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2SC3C(=CN=[N+](C3=O)C4=CC=CC=C4)S2

Isomeric SMILES

C1=CC=C(C=C1)C2SC3C(=CN=[N+](C3=O)C4=CC=CC=C4)S2

InChI

InChI=1S/C17H13N2OS2/c20-16-15-14(11-18-19(16)13-9-5-2-6-10-13)21-17(22-15)12-7-3-1-4-8-12/h1-11,15,17H/q+1