5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-(pyridin-4-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]methanone Formula: C18H22N3OS+ MolecularWeight: 328.45178

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2)C(=O)N3CC[NH+](CC3)CC4=CC=NC=C4

Isomeric SMILES

C1CC2=C(C1)SC(=C2)C(=O)N3CC[NH+](CC3)CC4=CC=NC=C4

InChI

InChI=1S/C18H21N3OS/c22-18(17-12-15-2-1-3-16(15)23-17)21-10-8-20(9-11-21)13-14-4-6-19-7-5-14/h4-7,12H,1-3,8-11,13H2/p+1