2-(2-methyl-1,3-thiazol-4-yl)ethanenitrile; perchloric acid

Systemtic Name: 2-(2-methyl-1,3-thiazol-4-yl)ethanenitrile; perchloric acid Openeye Name: 2-(2-methylthiazol-4-yl)acetonitrile; perchloric acid CAS Name: 2-(2-methyl-4-thiazolyl)acetonitrile; perchloric acid IUPAC Name: 2-(2-methyl-1,3-thiazol-4-yl)acetonitrile; perchloric acid Traditional Name: 2-(2-methylthiazol-4-yl)acetonitrile; perchloric acid Formula: C6H7ClN2O4S MolecularWeight: 238.64878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CC#N.OCl(=O)(=O)=O

Isomeric SMILES

CC1=NC(=CS1)CC#N.OCl(=O)(=O)=O

InChI

InChI=1S/C6H6N2S.ClHO4/c1-5-8-6(2-3-7)4-9-5;2-1(3,4)5/h4H,2H2,1H3;(H,2,3,4,5)