5-[5-(piperidin-1-ium-1-ylmethyl)thiophen-2-yl]-1-(pyridin-3-ylmethyl)-2H-imidazo[4,5-c]pyrazole

Systemtic Name: 5-[5-(piperidin-1-ium-1-ylmethyl)thiophen-2-yl]-1-(pyridin-3-ylmethyl)-2H-imidazo[4,5-c]pyrazole Openeye Name: 5-[5-(piperidin-1-ium-1-ylmethyl)-2-thienyl]-1-(3-pyridylmethyl)-2H-imidazo[4,5-c]pyrazole CAS Name: 5-[5-(1-piperidin-1-iumylmethyl)-2-thiophenyl]-1-(3-pyridinylmethyl)-2H-imidazo[4,5-c]pyrazole IUPAC Name: 5-[5-(piperidin-1-ium-1-ylmethyl)thiophen-2-yl]-1-(pyridin-3-ylmethyl)-2H-imidazo[4,5-c]pyrazole Traditional Name: 5-[5-(piperidin-1-ium-1-ylmethyl)-2-thienyl]-1-(3-pyridylmethyl)-2H-imidazo[4,5-c]pyrazole Formula: C20H23N6S+ MolecularWeight: 379.50182

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(S2)C3=NC4=CNN(C4=N3)CC5=CN=CC=C5

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(S2)C3=NC4=CNN(C4=N3)CC5=CN=CC=C5

InChI

InChI=1S/C20H22N6S/c1-2-9-25(10-3-1)14-16-6-7-18(27-16)19-23-17-12-22-26(20(17)24-19)13-15-5-4-8-21-11-15/h4-8,11-12,22H,1-3,9-10,13-14H2/p+1