methyl 2-[2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyloxy]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyloxy]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[2-(1,3-benzothiazol-2-ylthio)-1-oxoethoxy]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]oxyacetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[2-(1,3-benzothiazol-2-ylthio)acetyl]oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C19H18N2O5S3 MolecularWeight: 450.55162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)CSC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)CSC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C19H18N2O5S3/c1-10-11(2)28-17(16(10)18(24)25-3)21-14(22)8-26-15(23)9-27-19-20-12-6-4-5-7-13(12)29-19/h4-7H,8-9H2,1-3H3,(H,21,22)