methyl 2-[2-(4-pyridin-2-ylpiperazin-1-yl)ethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(4-pyridin-2-ylpiperazin-1-yl)ethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[4-(2-pyridyl)piperazin-1-yl]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(4-pyridin-2-ylpiperazin-1-yl)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Traditional Name: 2-[[2-[4-(2-pyridyl)piperazino]acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCC2)NC(=O)CN3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCC2)NC(=O)CN3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C20H24N4O3S/c1-27-20(26)18-14-5-4-6-15(14)28-19(18)22-17(25)13-23-9-11-24(12-10-23)16-7-2-3-8-21-16/h2-3,7-8H,4-6,9-13H2,1H3,(H,22,25)