[4-(2-pyridin-4-ylethyl)piperazin-1-yl]-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone

Systemtic Name: [4-(2-pyridin-4-ylethyl)piperazin-1-yl]-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone Openeye Name: [4-[2-(4-pyridyl)ethyl]piperazin-1-yl]-[5-[(2R)-pyrrolidin-1-ium-2-yl]-2-thienyl]methanone CAS Name: [4-(2-pyridin-4-ylethyl)-1-piperazinyl]-[5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenyl]methanone IUPAC Name: [4-(2-pyridin-4-ylethyl)piperazin-1-yl]-[5-[(2R)-pyrrolidin-1-ium-2-yl]thiophen-2-yl]methanone Traditional Name: [4-[2-(4-pyridyl)ethyl]piperazino]-[5-[(2R)-pyrrolidin-1-ium-2-yl]-2-thienyl]methanone Formula: C20H27N4OS+ MolecularWeight: 371.51958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C2=CC=C(S2)C(=O)N3CCN(CC3)CCC4=CC=NC=C4

Isomeric SMILES

C1C[C@@H]([NH2+]C1)C2=CC=C(S2)C(=O)N3CCN(CC3)CCC4=CC=NC=C4

InChI

InChI=1S/C20H26N4OS/c25-20(19-4-3-18(26-19)17-2-1-8-22-17)24-14-12-23(13-15-24)11-7-16-5-9-21-10-6-16/h3-6,9-10,17,22H,1-2,7-8,11-15H2/p+1/t17-/m1/s1