2-[[6-[2-(dimethylcarbamothioylsulfanyl)ethanoylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethyl ethanoate

Systemtic Name: 2-[[6-[2-(dimethylcarbamothioylsulfanyl)ethanoylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethyl ethanoate Openeye Name: 2-[[6-[[2-(dimethylcarbamothioylsulfanyl)acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]ethyl acetate CAS Name: acetic acid 2-[[6-[[2-[[dimethylamino(sulfanylidene)methyl]thio]-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]thio]ethyl ester IUPAC Name: 2-[[6-[[2-(dimethylcarbamothioylsulfanyl)acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]ethyl acetate Traditional Name: acetic acid 2-[[6-[[2-(dimethylthiocarbamoylthio)acetyl]amino]-1,3-benzothiazol-2-yl]thio]ethyl ester Formula: C16H19N3O3S4 MolecularWeight: 429.60036

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC(=S)N(C)C

Isomeric SMILES

CC(=O)OCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC(=S)N(C)C

InChI

InChI=1S/C16H19N3O3S4/c1-10(20)22-6-7-24-15-18-12-5-4-11(8-13(12)26-15)17-14(21)9-25-16(23)19(2)3/h4-5,8H,6-7,9H2,1-3H3,(H,17,21)