5-methyl-3-methylsulfonyl-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-methyl-3-methylsulfonyl-1,2-thiazole-4-carbonitrile Openeye Name: 5-methyl-3-methylsulfonyl-isothiazole-4-carbonitrile CAS Name: 5-methyl-3-methylsulfonyl-4-isothiazolecarbonitrile IUPAC Name: 5-methyl-3-methylsulfonyl-1,2-thiazole-4-carbonitrile Traditional Name: 3-mesyl-5-methyl-isothiazole-4-carbonitrile Formula: C6H6N2O2S2 MolecularWeight: 202.25404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NS1)S(=O)(=O)C)C#N

Isomeric SMILES

CC1=C(C(=NS1)S(=O)(=O)C)C#N

InChI

InChI=1S/C6H6N2O2S2/c1-4-5(3-7)6(8-11-4)12(2,9)10/h1-2H3