2-methylsulfanyl-5-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-1-amine

Systemtic Name: 2-methylsulfanyl-5-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-1-amine Openeye Name: 2-methylsulfanyl-5-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-1-amine CAS Name: 2-(methylthio)-5-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-1-amine IUPAC Name: 2-methylsulfanyl-5-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-1-amine Traditional Name: [2-(methylthio)-5-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-1-yl]amine Formula: C16H14N5S+ MolecularWeight: 308.38086

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=N[N+]2=C(N1N)C3=CC=CC=C3N=C2C4=CC=CC=C4

Isomeric SMILES

CSC1=N[N+]2=C(N1N)C3=CC=CC=C3N=C2C4=CC=CC=C4

InChI

InChI=1S/C16H14N5S/c1-22-16-19-21-14(11-7-3-2-4-8-11)18-13-10-6-5-9-12(13)15(21)20(16)17/h2-10H,17H2,1H3/q+1