1-(2-methoxyphenyl)-3-[2-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]urea

Systemtic Name: 1-(2-methoxyphenyl)-3-[2-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]urea Openeye Name: 1-(2-methoxyphenyl)-3-[2-[1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]urea CAS Name: 1-(2-methoxyphenyl)-3-[2-[1-[(6-methyl-2-pyridinyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]urea IUPAC Name: 1-(2-methoxyphenyl)-3-[2-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]urea Traditional Name: 1-(2-methoxyphenyl)-3-[2-[1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]urea Formula: C23H29N6O2+ MolecularWeight: 421.51536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)NC4=CC=CC=C4OC

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)NC4=CC=CC=C4OC

InChI

InChI=1S/C23H28N6O2/c1-17-6-5-7-18(25-17)16-28-14-11-19(12-15-28)29-22(10-13-24-29)27-23(30)26-20-8-3-4-9-21(20)31-2/h3-10,13,19H,11-12,14-16H2,1-2H3,(H2,26,27,30)/p+1