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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=NC2=C(N1)C3=CN=CC=C3)C4=CC=C(S4)C[NH+]5CCCCC5

Isomeric SMILES

CN1C2=NC(=NC2=C(N1)C3=CN=CC=C3)C4=CC=C(S4)C[NH+]5CCCCC5

InChI

InChI=1S/C20H22N6S/c1-25-20-18(17(24-25)14-6-5-9-21-12-14)22-19(23-20)16-8-7-15(27-16)13-26-10-3-2-4-11-26/h5-9,12,24H,2-4,10-11,13H2,1H3/p+1