ethyl 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H16N2O4S2 MolecularWeight: 412.48204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H16N2O4S2/c1-2-26-20(23)17-15(13-8-4-3-5-9-13)12-27-19(17)21-18-14-10-6-7-11-16(14)28(24,25)22-18/h3-12H,2H2,1H3,(H,21,22)