(3-methyl-5-sulfanylidene-1,2-dithiol-4-yl)methyl nitrate

Systemtic Name: (3-methyl-5-sulfanylidene-1,2-dithiol-4-yl)methyl nitrate Openeye Name: (3-methyl-5-thioxo-dithiol-4-yl)methyl nitrate CAS Name: nitric acid (3-methyl-5-sulfanylidene-4-dithiolyl)methyl ester IUPAC Name: (3-methyl-5-sulfanylidenedithiol-4-yl)methyl nitrate Traditional Name: nitric acid (3-methyl-5-thioxo-dithiol-4-yl)methyl ester Formula: C5H5NO3S3 MolecularWeight: 223.2931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=S)SS1)CO[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=S)SS1)CO[N+](=O)[O-]

InChI

InChI=1S/C5H5NO3S3/c1-3-4(2-9-6(7)8)5(10)12-11-3/h2H2,1H3