5-chloranyl-2-phenyl-4-(phenylmethyl)-1,2,4-thiadiazol-4-ium-3-one chloride

Systemtic Name: 5-chloranyl-2-phenyl-4-(phenylmethyl)-1,2,4-thiadiazol-4-ium-3-one chloride Openeye Name: 4-benzyl-5-chloro-2-phenyl-1,2,4-thiadiazol-4-ium-3-one chloride CAS Name: 5-chloro-2-phenyl-4-(phenylmethyl)-1,2,4-thiadiazol-4-ium-3-one chloride IUPAC Name: 4-benzyl-5-chloro-2-phenyl-1,2,4-thiadiazol-4-ium-3-one chloride Traditional Name: 4-benzyl-5-chloro-2-phenyl-1,2,4-thiadiazol-4-ium-3-one chloride Formula: C15H12Cl2N2OS MolecularWeight: 339.23958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(SN(C2=O)C3=CC=CC=C3)Cl.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(SN(C2=O)C3=CC=CC=C3)Cl.[Cl-]

InChI

InChI=1S/C15H12ClN2OS.ClH/c16-14-17(11-12-7-3-1-4-8-12)15(19)18(20-14)13-9-5-2-6-10-13;/h1-10H,11H2;1H/q+1;/p-1