2-[[4-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]-4-phenyl-1,3-thiazole

Systemtic Name: 2-[[4-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]-4-phenyl-1,3-thiazole Openeye Name: 2-[[4-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]-4-phenyl-thiazole CAS Name: 2-[[4-(4-ethyl-1H-pyrazol-5-yl)-1-piperidin-1-iumyl]methyl]-4-phenylthiazole IUPAC Name: 2-[[4-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]-4-phenyl-1,3-thiazole Traditional Name: 2-[[4-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium-1-yl]methyl]-4-phenyl-thiazole Formula: C20H25N4S+ MolecularWeight: 353.5043

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NN=C1)C2CC[NH+](CC2)CC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(NN=C1)C2CC[NH+](CC2)CC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H24N4S/c1-2-15-12-21-23-20(15)17-8-10-24(11-9-17)13-19-22-18(14-25-19)16-6-4-3-5-7-16/h3-7,12,14,17H,2,8-11,13H2,1H3,(H,21,23)/p+1