[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 4,5-dimethoxy-2-(2-thiophen-2-ylethanoylamino)benzoate

Systemtic Name: [2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 4,5-dimethoxy-2-(2-thiophen-2-ylethanoylamino)benzoate Openeye Name: [2-(5-chloro-2-thienyl)-2-oxo-ethyl] 4,5-dimethoxy-2-[[2-(2-thienyl)acetyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[(1-oxo-2-thiophen-2-ylethyl)amino]benzoic acid [2-(5-chloro-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-chlorothiophen-2-yl)-2-oxoethyl] 4,5-dimethoxy-2-[(2-thiophen-2-ylacetyl)amino]benzoate Traditional Name: 4,5-dimethoxy-2-[[2-(2-thienyl)acetyl]amino]benzoic acid [2-(5-chloro-2-thienyl)-2-keto-ethyl] ester Formula: C21H18ClNO6S2 MolecularWeight: 479.95372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)C2=CC=C(S2)Cl)NC(=O)CC3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)C2=CC=C(S2)Cl)NC(=O)CC3=CC=CS3)OC

InChI

InChI=1S/C21H18ClNO6S2/c1-27-16-9-13(21(26)29-11-15(24)18-5-6-19(22)31-18)14(10-17(16)28-2)23-20(25)8-12-4-3-7-30-12/h3-7,9-10H,8,11H2,1-2H3,(H,23,25)