3-[1-(dioxidanyl)ethenyl]-5-methyl-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-[1-(dioxidanyl)ethenyl]-5-methyl-1,2-thiazole-4-carbonitrile Openeye Name: 3-(1-hydroperoxyvinyl)-5-methyl-isothiazole-4-carbonitrile CAS Name: 3-(1-hydroperoxyethenyl)-5-methyl-4-isothiazolecarbonitrile IUPAC Name: 3-(1-hydroperoxyethenyl)-5-methyl-1,2-thiazole-4-carbonitrile Traditional Name: 3-(1-hydroperoxyvinyl)-5-methyl-isothiazole-4-carbonitrile Formula: C7H6N2O2S MolecularWeight: 182.19974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NS1)C(=C)OO)C#N

Isomeric SMILES

CC1=C(C(=NS1)C(=C)OO)C#N

InChI

InChI=1S/C7H6N2O2S/c1-4(11-10)7-6(3-8)5(2)12-9-7/h10H,1H2,2H3