2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[(6-ethoxy-1H-benzimidazol-2-yl)thio]methyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[(6-ethoxy-1H-benzimidazol-2-yl)thio]methyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C19H19N4O2S+ MolecularWeight: 367.44476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SCC3=CC(=O)[N+]4=C(C=CC=C4N3)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SCC3=CC(=O)[N+]4=C(C=CC=C4N3)C

InChI

InChI=1S/C19H18N4O2S/c1-3-25-14-7-8-15-16(10-14)22-19(21-15)26-11-13-9-18(24)23-12(2)5-4-6-17(23)20-13/h4-10H,3,11H2,1-2H3,(H,21,22)/p+1