ethyl (2S)-3-sulfanylidene-4H-1,4-benzothiazine-2-carboxylate

Systemtic Name: ethyl (2S)-3-sulfanylidene-4H-1,4-benzothiazine-2-carboxylate Openeye Name: ethyl (2S)-3-thioxo-4H-1,4-benzothiazine-2-carboxylate CAS Name: (2S)-3-sulfanylidene-4H-1,4-benzothiazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl (2S)-3-sulfanylidene-4H-1,4-benzothiazine-2-carboxylate Traditional Name: (2S)-3-thioxo-4H-1,4-benzothiazine-2-carboxylic acid ethyl ester Formula: C11H11NO2S2 MolecularWeight: 253.34054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=S)NC2=CC=CC=C2S1

Isomeric SMILES

CCOC(=O)[C@H]1C(=S)NC2=CC=CC=C2S1

InChI

InChI=1S/C11H11NO2S2/c1-2-14-11(13)9-10(15)12-7-5-3-4-6-8(7)16-9/h3-6,9H,2H2,1H3,(H,12,15)/t9-/m1/s1