[2-oxidanylidene-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl] N,N-dimethylcarbamodithioate

Systemtic Name: [2-oxidanylidene-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl] N,N-dimethylcarbamodithioate Openeye Name: [2-[[2-(2-isopropylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]-2-oxo-ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [2-oxo-2-[[2-[2-(propan-2-ylthio)ethylthio]-1,3-benzothiazol-6-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [2-[[2-[2-(isopropylthio)ethylthio]-1,3-benzothiazol-6-yl]amino]-2-keto-ethyl] ester Formula: C17H23N3OS5 MolecularWeight: 445.70902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC(=S)N(C)C

Isomeric SMILES

CC(C)SCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC(=S)N(C)C

InChI

InChI=1S/C17H23N3OS5/c1-11(2)23-7-8-24-16-19-13-6-5-12(9-14(13)26-16)18-15(21)10-25-17(22)20(3)4/h5-6,9,11H,7-8,10H2,1-4H3,(H,18,21)