ethyl 2-[2-(6-bromanyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(6-bromanyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(6-bromo-3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-(6-bromo-3-oxo-4H-1,4-benzothiazin-2-yl)-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(6-bromo-3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-(6-bromo-3-keto-4H-1,4-benzothiazin-2-yl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C19H19BrN2O4S2 MolecularWeight: 483.39916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CC2C(=O)NC3=C(S2)C=CC(=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CC2C(=O)NC3=C(S2)C=CC(=C3)Br

InChI

InChI=1S/C19H19BrN2O4S2/c1-4-26-19(25)16-9(2)10(3)27-18(16)22-15(23)8-14-17(24)21-12-7-11(20)5-6-13(12)28-14/h5-7,14H,4,8H2,1-3H3,(H,21,24)(H,22,23)