7-chloranyl-2-(phenylmethylsulfanyl)-1H-pyrido[1,2-a][1,3,5]triazin-5-ium-4-one

Systemtic Name: 7-chloranyl-2-(phenylmethylsulfanyl)-1H-pyrido[1,2-a][1,3,5]triazin-5-ium-4-one Openeye Name: 2-benzylsulfanyl-7-chloro-1H-pyrido[1,2-a][1,3,5]triazin-5-ium-4-one CAS Name: 7-chloro-2-(phenylmethylthio)-1H-pyrido[1,2-a][1,3,5]triazin-5-ium-4-one IUPAC Name: 2-benzylsulfanyl-7-chloro-1H-pyrido[1,2-a][1,3,5]triazin-5-ium-4-one Traditional Name: 2-(benzylthio)-7-chloro-1H-pyrido[1,2-a][1,3,5]triazin-5-ium-4-one Formula: C14H11ClN3OS+ MolecularWeight: 304.77464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=O)[N+]3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=O)[N+]3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C14H10ClN3OS/c15-11-6-7-12-16-13(17-14(19)18(12)8-11)20-9-10-4-2-1-3-5-10/h1-8H,9H2/p+1