5-azanyl-2,3-diphenyl-1H-pyridazin-2-ium-6-thione perchlorate

Systemtic Name: 5-azanyl-2,3-diphenyl-1H-pyridazin-2-ium-6-thione perchlorate Openeye Name: 5-amino-2,3-diphenyl-1H-pyridazin-2-ium-6-thione perchlorate CAS Name: 5-amino-2,3-diphenyl-1H-pyridazin-2-ium-6-thione perchlorate IUPAC Name: 5-amino-2,3-diphenyl-1H-pyridazin-2-ium-6-thione perchlorate Traditional Name: 5-amino-2,3-diphenyl-1H-pyridazin-2-ium-6-thione perchlorate Formula: C16H14ClN3O4S MolecularWeight: 379.81806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[N+](NC(=S)C(=C2)N)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=[N+](NC(=S)C(=C2)N)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C16H13N3S.ClHO4/c17-14-11-15(12-7-3-1-4-8-12)19(18-16(14)20)13-9-5-2-6-10-13;2-1(3,4)5/h1-11,17H,(H,18,20);(H,2,3,4,5)