ethyl 4-[[(2E)-2-[(4-ethoxy-3-methoxy-phenyl)methylidene]-4-methyl-3-oxidanylidene-1,4-benzothiazin-6-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[(2E)-2-[(4-ethoxy-3-methoxy-phenyl)methylidene]-4-methyl-3-oxidanylidene-1,4-benzothiazin-6-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[(2E)-2-[(4-ethoxy-3-methoxy-phenyl)methylene]-4-methyl-3-oxo-1,4-benzothiazine-6-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[(2E)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-4-methyl-3-oxo-1,4-benzothiazin-6-yl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(2E)-2-[(4-ethoxy-3-methoxyphenyl)methylidene]-4-methyl-3-oxo-1,4-benzothiazine-6-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[(2E)-2-(4-ethoxy-3-methoxy-benzylidene)-3-keto-4-methyl-1,4-benzothiazine-6-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C28H33N3O6S MolecularWeight: 539.64312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=C2C(=O)N(C3=C(S2)C=CC(=C3)C(=O)NC4CCN(CC4)C(=O)OCC)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C/2\C(=O)N(C3=C(S2)C=CC(=C3)C(=O)NC4CCN(CC4)C(=O)OCC)C)OC

InChI

InChI=1S/C28H33N3O6S/c1-5-36-22-9-7-18(15-23(22)35-4)16-25-27(33)30(3)21-17-19(8-10-24(21)38-25)26(32)29-20-11-13-31(14-12-20)28(34)37-6-2/h7-10,15-17,20H,5-6,11-14H2,1-4H3,(H,29,32)/b25-16+