ethyl 5-[7-(4-ethylpiperazin-1-yl)thieno[2,3-c]pyridin-5-yl]-2-methyl-3H-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-[7-(4-ethylpiperazin-1-yl)thieno[2,3-c]pyridin-5-yl]-2-methyl-3H-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-[7-(4-ethylpiperazin-1-yl)thieno[2,3-c]pyridin-5-yl]-2-methyl-3H-benzofuran-2-carboxylate CAS Name: 5-[7-(4-ethyl-1-piperazinyl)-5-thieno[2,3-c]pyridinyl]-2-methyl-3H-benzofuran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[7-(4-ethylpiperazin-1-yl)thieno[2,3-c]pyridin-5-yl]-2-methyl-3H-1-benzofuran-2-carboxylate Traditional Name: 5-[7-(4-ethylpiperazino)thieno[2,3-c]pyridin-5-yl]-2-methyl-coumaran-2-carboxylic acid ethyl ester Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C3C(=CC(=N2)C4=CC5=C(C=C4)OC(C5)(C)C(=O)OCC)C=CS3

Isomeric SMILES

CCN1CCN(CC1)C2=C3C(=CC(=N2)C4=CC5=C(C=C4)OC(C5)(C)C(=O)OCC)C=CS3

InChI

InChI=1S/C25H29N3O3S/c1-4-27-9-11-28(12-10-27)23-22-18(8-13-32-22)15-20(26-23)17-6-7-21-19(14-17)16-25(3,31-21)24(29)30-5-2/h6-8,13-15H,4-5,9-12,16H2,1-3H3