7-methyl-5-methylsulfanyl-benzimidazolo[1,2-a][1,8]naphthyridin-12-ium-6-carbonitrile

Systemtic Name: 7-methyl-5-methylsulfanyl-benzimidazolo[1,2-a][1,8]naphthyridin-12-ium-6-carbonitrile Openeye Name: 7-methyl-5-methylsulfanyl-benzimidazolo[1,2-a][1,8]naphthyridin-12-ium-6-carbonitrile CAS Name: 7-methyl-5-(methylthio)-6-benzimidazolo[1,2-a][1,8]naphthyridin-12-iumcarbonitrile IUPAC Name: 7-methyl-5-methylsulfanylbenzimidazolo[1,2-a][1,8]naphthyridin-12-ium-6-carbonitrile Traditional Name: 7-methyl-5-(methylthio)benzimidazolo[1,2-a][1,8]naphthyridin-12-ium-6-carbonitrile Formula: C17H13N4S+ MolecularWeight: 305.37692

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2[N+]3=C1C(=C(C4=C3N=CC=C4)SC)C#N

Isomeric SMILES

CN1C2=CC=CC=C2[N+]3=C1C(=C(C4=C3N=CC=C4)SC)C#N

InChI

InChI=1S/C17H13N4S/c1-20-13-7-3-4-8-14(13)21-16-11(6-5-9-19-16)15(22-2)12(10-18)17(20)21/h3-9H,1-2H3/q+1