1-methyl-3-(phenylmethyl)-2H-1,2,6-thiadiazin-1-ium-5-one chloride

Systemtic Name: 1-methyl-3-(phenylmethyl)-2H-1,2,6-thiadiazin-1-ium-5-one chloride Openeye Name: 3-benzyl-1-methyl-2H-1,2,6-thiadiazin-1-ium-5-one chloride CAS Name: 1-methyl-3-(phenylmethyl)-2H-1,2,6-thiadiazin-1-ium-5-one chloride IUPAC Name: 3-benzyl-1-methyl-2H-1,2,6-thiadiazin-1-ium-5-one chloride Traditional Name: 3-benzyl-1-methyl-2H-1,2,6-thiadiazin-1-ium-5-one chloride Formula: C11H13ClN2OS MolecularWeight: 256.75172

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Descriptors Computed from Structure

Canonical SMILES:

C[S+]1NC(=CC(=O)N1)CC2=CC=CC=C2.[Cl-]

Isomeric SMILES

C[S+]1NC(=CC(=O)N1)CC2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C11H12N2OS.ClH/c1-15-12-10(8-11(14)13-15)7-9-5-3-2-4-6-9;/h2-6,8H,7H2,1H3,(H-,12,13,14);1H