1-[2-[1-(3-cyclopentylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-3-(3-fluorophenyl)urea

Systemtic Name: 1-[2-[1-(3-cyclopentylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-3-(3-fluorophenyl)urea Openeye Name: 1-[2-[1-(3-cyclopentylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-3-(3-fluorophenyl)urea CAS Name: 1-[2-[1-(3-cyclopentylpropyl)-4-piperidin-1-iumyl]-3-pyrazolyl]-3-(3-fluorophenyl)urea IUPAC Name: 1-[2-[1-(3-cyclopentylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-3-(3-fluorophenyl)urea Traditional Name: 1-[2-[1-(3-cyclopentylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]-3-(3-fluorophenyl)urea Formula: C23H33FN5O+ MolecularWeight: 414.539423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)NC4=CC(=CC=C4)F

Isomeric SMILES

C1CCC(C1)CCC[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)NC4=CC(=CC=C4)F

InChI

InChI=1S/C23H32FN5O/c24-19-8-3-9-20(17-19)26-23(30)27-22-10-13-25-29(22)21-11-15-28(16-12-21)14-4-7-18-5-1-2-6-18/h3,8-10,13,17-18,21H,1-2,4-7,11-12,14-16H2,(H2,26,27,30)/p+1