2-[2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Systemtic Name: 2-[2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Openeye Name: 2-[2-[4-(3-pyridylsulfonyl)piperazin-1-yl]propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide CAS Name: 2-[[1-oxo-2-[4-(3-pyridinylsulfonyl)-1-piperazinyl]propyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide IUPAC Name: 2-[2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Traditional Name: 2-[2-[4-(3-pyridylsulfonyl)piperazino]propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Formula: C20H25N5O4S2 MolecularWeight: 463.5736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C2=C(S1)CCC2)C(=O)N)N3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CC(C(=O)NC1=C(C2=C(S1)CCC2)C(=O)N)N3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C20H25N5O4S2/c1-13(19(27)23-20-17(18(21)26)15-5-2-6-16(15)30-20)24-8-10-25(11-9-24)31(28,29)14-4-3-7-22-12-14/h3-4,7,12-13H,2,5-6,8-11H2,1H3,(H2,21,26)(H,23,27)