[(3R)-3-isothiocyanato-1,1-bis(oxidanylidene)-2,3-dihydrothiophen-4-yl]methyl thiocyanate

Systemtic Name: [(3R)-3-isothiocyanato-1,1-bis(oxidanylidene)-2,3-dihydrothiophen-4-yl]methyl thiocyanate Openeye Name: [(3R)-3-isothiocyanato-1,1-dioxo-2,3-dihydrothiophen-4-yl]methyl thiocyanate CAS Name: thiocyanic acid [(3R)-3-isothiocyanato-1,1-dioxo-2,3-dihydrothiophen-4-yl]methyl ester IUPAC Name: [(3R)-3-isothiocyanato-1,1-dioxo-2,3-dihydrothiophen-4-yl]methyl thiocyanate Traditional Name: thiocyanic acid [(3R)-3-isothiocyanato-1,1-diketo-2,3-dihydrothiophen-4-yl]methyl ester Formula: C7H6N2O2S3 MolecularWeight: 246.32974

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=CS1(=O)=O)CSC#N)N=C=S

Isomeric SMILES

C1[C@@H](C(=CS1(=O)=O)CSC#N)N=C=S

InChI

InChI=1S/C7H6N2O2S3/c8-4-13-1-6-2-14(10,11)3-7(6)9-5-12/h2,7H,1,3H2/t7-/m0/s1