2,9-dimethyl-3-methylsulfanyl-[1,2,4]triazino[6,5-b]indol-2-ium

Systemtic Name: 2,9-dimethyl-3-methylsulfanyl-[1,2,4]triazino[6,5-b]indol-2-ium Openeye Name: 2,9-dimethyl-3-methylsulfanyl-[1,2,4]triazino[6,5-b]indol-2-ium CAS Name: 2,9-dimethyl-3-(methylthio)-[1,2,4]triazino[6,5-b]indol-2-ium IUPAC Name: 2,9-dimethyl-3-methylsulfanyl-[1,2,4]triazino[6,5-b]indol-2-ium Traditional Name: 2,9-dimethyl-3-(methylthio)-[1,2,4]triazin[6,5-b]indol-2-ium Formula: C12H13N4S+ MolecularWeight: 245.32342

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C3=C1N=[N+](C(=N3)SC)C

Isomeric SMILES

CN1C2=CC=CC=C2C3=C1N=[N+](C(=N3)SC)C

InChI

InChI=1S/C12H13N4S/c1-15-9-7-5-4-6-8(9)10-11(15)14-16(2)12(13-10)17-3/h4-7H,1-3H3/q+1