ethyl 3-[2-(6-bromanyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-(6-bromanyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(6-bromo-3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]benzoate CAS Name: 3-[[2-(6-bromo-3-oxo-4H-1,4-benzothiazin-2-yl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(6-bromo-3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(6-bromo-3-keto-4H-1,4-benzothiazin-2-yl)acetyl]amino]benzoic acid ethyl ester Formula: C19H17BrN2O4S MolecularWeight: 449.31828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrN2O4S/c1-2-26-19(25)11-4-3-5-13(8-11)21-17(23)10-16-18(24)22-14-9-12(20)6-7-15(14)27-16/h3-9,16H,2,10H2,1H3,(H,21,23)(H,22,24)