3-methylsulfanyl-5-phenyl-1,4,2-dithiazol-4-ium perchlorate

Systemtic Name: 3-methylsulfanyl-5-phenyl-1,4,2-dithiazol-4-ium perchlorate Openeye Name: 3-methylsulfanyl-5-phenyl-1,4,2-dithiazol-4-ium perchlorate CAS Name: 3-(methylthio)-5-phenyl-1,4,2-dithiazol-4-ium perchlorate IUPAC Name: 3-methylsulfanyl-5-phenyl-1,4,2-dithiazol-4-ium perchlorate Traditional Name: 3-(methylthio)-5-phenyl-1,4,2-dithiazol-4-ium perchlorate Formula: C9H8ClNO4S3 MolecularWeight: 325.81212

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NSC(=[S+]1)C2=CC=CC=C2.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CSC1=NSC(=[S+]1)C2=CC=CC=C2.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C9H8NS3.ClHO4/c1-11-9-10-13-8(12-9)7-5-3-2-4-6-7;2-1(3,4)5/h2-6H,1H3;(H,2,3,4,5)/q+1;/p-1