O-propan-2-yl [1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methylsulfanylmethanethioate

Systemtic Name: O-propan-2-yl [1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methylsulfanylmethanethioate Openeye Name: O-isopropyl (1,1,3-trioxo-1,2-benzothiazol-2-yl)methylsulfanylmethanethioate CAS Name: [(1,1,3-trioxo-1,2-benzothiazol-2-yl)methylthio]methanethioic acid O-propan-2-yl ester IUPAC Name: O-propan-2-yl (1,1,3-trioxo-1,2-benzothiazol-2-yl)methylsulfanylmethanethioate Traditional Name: [(1,1,3-triketo-1,2-benzothiazol-2-yl)methylthio]methanethioic acid O-isopropyl ester Formula: C12H13NO4S3 MolecularWeight: 331.43092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=S)SCN1C(=O)C2=CC=CC=C2S1(=O)=O

Isomeric SMILES

CC(C)OC(=S)SCN1C(=O)C2=CC=CC=C2S1(=O)=O

InChI

InChI=1S/C12H13NO4S3/c1-8(2)17-12(18)19-7-13-11(14)9-5-3-4-6-10(9)20(13,15)16/h3-6,8H,7H2,1-2H3