[2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-oxidanylidene-ethyl] 5-(furan-2-ylcarbonylamino)thiophene-2-carboxylate

Systemtic Name: [2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-oxidanylidene-ethyl] 5-(furan-2-ylcarbonylamino)thiophene-2-carboxylate Openeye Name: [2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-oxo-ethyl] 5-(furan-2-carbonylamino)thiophene-2-carboxylate CAS Name: 5-[[2-furanyl(oxo)methyl]amino]-2-thiophenecarboxylic acid [2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-oxoethyl] 5-(furan-2-carbonylamino)thiophene-2-carboxylate Traditional Name: 5-(2-furoylamino)thiophene-2-carboxylic acid [2-[1,3-benzothiazol-2-yl(ethyl)amino]-2-keto-ethyl] ester Formula: C21H17N3O5S2 MolecularWeight: 455.50678

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)COC(=O)C3=CC=C(S3)NC(=O)C4=CC=CO4

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)COC(=O)C3=CC=C(S3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C21H17N3O5S2/c1-2-24(21-22-13-6-3-4-8-15(13)31-21)18(25)12-29-20(27)16-9-10-17(30-16)23-19(26)14-7-5-11-28-14/h3-11H,2,12H2,1H3,(H,23,26)