7-bromanyl-2-(naphthalen-2-ylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 7-bromanyl-2-(naphthalen-2-ylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-bromo-2-(2-naphthylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-bromo-2-[(2-naphthalenylthio)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 7-bromo-2-(naphthalen-2-ylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 7-bromo-2-[(2-naphthylthio)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C19H14BrN2OS+ MolecularWeight: 398.29626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)SCC3=CC(=O)[N+]4=C(N3)C=CC(=C4)Br

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)SCC3=CC(=O)[N+]4=C(N3)C=CC(=C4)Br

InChI

InChI=1S/C19H13BrN2OS/c20-15-6-8-18-21-16(10-19(23)22(18)11-15)12-24-17-7-5-13-3-1-2-4-14(13)9-17/h1-11H,12H2/p+1