N-[3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-4-fluoro-benzamide CAS Name: N-[3-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-4-fluorobenzamide IUPAC Name: N-[3-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-4-fluorobenzamide Traditional Name: 4-fluoro-N-[3-[(4-piperonylpiperazino)methyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]benzamide Formula: C27H28FN3O3S MolecularWeight: 493.592923

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)NC(=O)C6=CC=C(C=C6)F

Isomeric SMILES

C1CC2=C(C1)SC(=C2CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)NC(=O)C6=CC=C(C=C6)F

InChI

InChI=1S/C27H28FN3O3S/c28-20-7-5-19(6-8-20)26(32)29-27-22(21-2-1-3-25(21)35-27)16-31-12-10-30(11-13-31)15-18-4-9-23-24(14-18)34-17-33-23/h4-9,14H,1-3,10-13,15-17H2,(H,29,32)