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

Systemtic Name: ethyl 3-methyl-5-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[(3-oxo-4H-1,4-benzothiazine-6-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 5-[(3-keto-4H-1,4-benzothiazine-6-carbonyl)amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C17H16N2O4S2 MolecularWeight: 376.44994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC3=C(C=C2)SCC(=O)N3)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC3=C(C=C2)SCC(=O)N3)C

InChI

InChI=1S/C17H16N2O4S2/c1-3-23-17(22)15-9(2)6-14(25-15)19-16(21)10-4-5-12-11(7-10)18-13(20)8-24-12/h4-7H,3,8H2,1-2H3,(H,18,20)(H,19,21)