ethyl 5-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 5-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]benzothiophene-2-carboxylate CAS Name: 5-[[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]amino]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[(3-keto-4H-1,4-benzothiazine-6-carbonyl)amino]benzothiophene-2-carboxylic acid ethyl ester Formula: C20H16N2O4S2 MolecularWeight: 412.48204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C20H16N2O4S2/c1-2-26-20(25)17-9-12-7-13(4-6-15(12)28-17)21-19(24)11-3-5-16-14(8-11)22-18(23)10-27-16/h3-9H,2,10H2,1H3,(H,21,24)(H,22,23)