1-[(6-pyrazol-1-ylpyridin-3-yl)methyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea

Systemtic Name: 1-[(6-pyrazol-1-ylpyridin-3-yl)methyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea Openeye Name: 1-[(6-pyrazol-1-yl-3-pyridyl)methyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea CAS Name: 1-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]-3-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)urea IUPAC Name: 1-[(6-pyrazol-1-ylpyridin-3-yl)methyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea Traditional Name: 1-[(6-pyrazol-1-yl-3-pyridyl)methyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea Formula: C19H29N6O+ MolecularWeight: 357.47316

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)NCC2=CN=C(C=C2)N3C=CC=N3)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)NCC2=CN=C(C=C2)N3C=CC=N3)C

InChI

InChI=1S/C19H28N6O/c1-18(2)10-15(11-19(3,4)24-18)23-17(26)21-13-14-6-7-16(20-12-14)25-9-5-8-22-25/h5-9,12,15,24H,10-11,13H2,1-4H3,(H2,21,23,26)/p+1