2-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C23H18ClN4OS+ MolecularWeight: 433.93322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2SCC4=CC(=O)[N+]5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2SCC4=CC(=O)[N+]5=CC=CC=C5N4

InChI

InChI=1S/C23H17ClN4OS/c24-17-9-10-20-19(12-17)26-23(28(20)14-16-6-2-1-3-7-16)30-15-18-13-22(29)27-11-5-4-8-21(27)25-18/h1-13H,14-15H2/p+1