2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-phenyl-amino]ethyl thiophene-2-carboxylate

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]-phenyl-amino]ethyl thiophene-2-carboxylate Openeye Name: 2-(N-(1,1-dioxo-1,2-benzothiazol-3-yl)anilino)ethyl thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid 2-(N-(1,1-dioxo-1,2-benzothiazol-3-yl)anilino)ethyl ester IUPAC Name: 2-(N-(1,1-dioxo-1,2-benzothiazol-3-yl)anilino)ethyl thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid 2-(N-(1,1-diketo-1,2-benzothiazol-3-yl)anilino)ethyl ester Formula: C20H16N2O4S2 MolecularWeight: 412.48204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCOC(=O)C2=CC=CS2)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)N(CCOC(=O)C2=CC=CS2)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H16N2O4S2/c23-20(17-10-6-14-27-17)26-13-12-22(15-7-2-1-3-8-15)19-16-9-4-5-11-18(16)28(24,25)21-19/h1-11,14H,12-13H2