ethyl 6-bromanyl-4-ethanoyl-2-methyl-thieno[2,3-b][1,4]benzothiazine-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-4-ethanoyl-2-methyl-thieno[2,3-b][1,4]benzothiazine-3-carboxylate Openeye Name: ethyl 4-acetyl-6-bromo-2-methyl-thieno[2,3-b][1,4]benzothiazine-3-carboxylate CAS Name: 4-acetyl-6-bromo-2-methyl-3-thieno[2,3-b][1,4]benzothiazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-6-bromo-2-methylthieno[2,3-b][1,4]benzothiazine-3-carboxylate Traditional Name: 4-acetyl-6-bromo-2-methyl-thieno[2,3-b][1,4]benzothiazine-3-carboxylic acid ethyl ester Formula: C16H14BrNO3S2 MolecularWeight: 412.32126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1N(C3=C(S2)C=CC(=C3)Br)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1N(C3=C(S2)C=CC(=C3)Br)C(=O)C)C

InChI

InChI=1S/C16H14BrNO3S2/c1-4-21-15(20)13-8(2)22-16-14(13)18(9(3)19)11-7-10(17)5-6-12(11)23-16/h5-7H,4H2,1-3H3