1-(4-methylphenyl)-2-methylsulfanyl-5-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-4-ium

Systemtic Name: 1-(4-methylphenyl)-2-methylsulfanyl-5-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-4-ium Openeye Name: 2-methylsulfanyl-5-phenyl-1-(p-tolyl)-[1,2,4]triazolo[1,5-c]quinazolin-4-ium CAS Name: 1-(4-methylphenyl)-2-(methylthio)-5-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-4-ium IUPAC Name: 1-(4-methylphenyl)-2-methylsulfanyl-5-phenyl-[1,2,4]triazolo[1,5-c]quinazolin-4-ium Traditional Name: 2-(methylthio)-5-phenyl-1-(p-tolyl)-[1,2,4]triazolo[1,5-c]quinazolin-4-ium Formula: C23H19N4S+ MolecularWeight: 383.48876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=[N+](C(=NC4=CC=CC=C43)C5=CC=CC=C5)N=C2SC

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=[N+](C(=NC4=CC=CC=C43)C5=CC=CC=C5)N=C2SC

InChI

InChI=1S/C23H19N4S/c1-16-12-14-18(15-13-16)26-22-19-10-6-7-11-20(19)24-21(17-8-4-3-5-9-17)27(22)25-23(26)28-2/h3-15H,1-2H3/q+1