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

Systemtic Name: [2-oxidanylidene-2-[[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl] N,N-dimethylcarbamodithioate Openeye Name: [2-oxo-2-[[2-[2-(3-thienyl)ethylsulfanyl]-1,3-benzothiazol-6-yl]amino]ethyl] N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [2-oxo-2-[[2-[2-(3-thiophenyl)ethylthio]-1,3-benzothiazol-6-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[2-(2-thiophen-3-ylethylsulfanyl)-1,3-benzothiazol-6-yl]amino]ethyl] N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [2-keto-2-[[2-[2-(3-thienyl)ethylthio]-1,3-benzothiazol-6-yl]amino]ethyl] ester Formula: C18H19N3OS5 MolecularWeight: 453.68796

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=S)SCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCCC3=CSC=C3

Isomeric SMILES

CN(C)C(=S)SCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCCC3=CSC=C3

InChI

InChI=1S/C18H19N3OS5/c1-21(2)18(23)26-11-16(22)19-13-3-4-14-15(9-13)27-17(20-14)25-8-6-12-5-7-24-10-12/h3-5,7,9-10H,6,8,11H2,1-2H3,(H,19,22)