(2-benzamido-2-oxidanylidene-ethyl) (3aR)-1-oxidanylidene-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) (3aR)-1-oxidanylidene-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylate Openeye Name: (2-benzamido-2-oxo-ethyl) (3aR)-1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylate CAS Name: (3aR)-1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) (3aR)-1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylate Traditional Name: (3aR)-1-keto-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxylic acid (2-benzamido-2-keto-ethyl) ester Formula: C20H16N2O5S MolecularWeight: 396.41644

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(N(C1=O)C3=CC=CC=C3S2)C(=O)OCC(=O)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C[C@]2(N(C1=O)C3=CC=CC=C3S2)C(=O)OCC(=O)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H16N2O5S/c23-16(21-18(25)13-6-2-1-3-7-13)12-27-19(26)20-11-10-17(24)22(20)14-8-4-5-9-15(14)28-20/h1-9H,10-12H2,(H,21,23,25)/t20-/m1/s1