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

Systemtic Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanylmethyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[(6-methoxy-1H-benzimidazol-2-yl)thio]methyl]-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C18H17N4O2S+ MolecularWeight: 353.41818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C(=CC=C1)NC(=CC2=O)CSC3=NC4=C(N3)C=C(C=C4)OC

Isomeric SMILES

CC1=[N+]2C(=CC=C1)NC(=CC2=O)CSC3=NC4=C(N3)C=C(C=C4)OC

InChI

InChI=1S/C18H16N4O2S/c1-11-4-3-5-16-19-12(8-17(23)22(11)16)10-25-18-20-14-7-6-13(24-2)9-15(14)21-18/h3-9H,10H2,1-2H3,(H,20,21)/p+1