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

Systemtic Name: 1-methyl-3-pyridin-2-yl-5-[4-(pyrrolidin-1-ium-1-ylmethyl)thiophen-2-yl]-2H-imidazo[4,5-c]pyrazole Openeye Name: 1-methyl-3-(2-pyridyl)-5-[4-(pyrrolidin-1-ium-1-ylmethyl)-2-thienyl]-2H-imidazo[4,5-c]pyrazole CAS Name: 1-methyl-3-(2-pyridinyl)-5-[4-(1-pyrrolidin-1-iumylmethyl)-2-thiophenyl]-2H-imidazo[4,5-c]pyrazole IUPAC Name: 1-methyl-3-pyridin-2-yl-5-[4-(pyrrolidin-1-ium-1-ylmethyl)thiophen-2-yl]-2H-imidazo[4,5-c]pyrazole Traditional Name: 1-methyl-3-(2-pyridyl)-5-[4-(pyrrolidin-1-ium-1-ylmethyl)-2-thienyl]-2H-imidazo[4,5-c]pyrazole Formula: C19H21N6S+ MolecularWeight: 365.47524

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=NC2=C(N1)C3=CC=CC=N3)C4=CC(=CS4)C[NH+]5CCCC5

Isomeric SMILES

CN1C2=NC(=NC2=C(N1)C3=CC=CC=N3)C4=CC(=CS4)C[NH+]5CCCC5

InChI

InChI=1S/C19H20N6S/c1-24-19-17(16(23-24)14-6-2-3-7-20-14)21-18(22-19)15-10-13(12-26-15)11-25-8-4-5-9-25/h2-3,6-7,10,12,23H,4-5,8-9,11H2,1H3/p+1