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

Systemtic Name: 1-(3-fluorophenyl)-3-[2-[1-(1-methylsulfanylpropan-2-yl)piperidin-4-yl]pyrazol-3-yl]urea Openeye Name: 1-(3-fluorophenyl)-3-[2-[1-(1-methyl-2-methylsulfanyl-ethyl)-4-piperidyl]pyrazol-3-yl]urea CAS Name: 1-(3-fluorophenyl)-3-[2-[1-[1-(methylthio)propan-2-yl]-4-piperidinyl]-3-pyrazolyl]urea IUPAC Name: 1-(3-fluorophenyl)-3-[2-[1-(1-methylsulfanylpropan-2-yl)piperidin-4-yl]pyrazol-3-yl]urea Traditional Name: 1-(3-fluorophenyl)-3-[2-[1-[1-methyl-2-(methylthio)ethyl]-4-piperidyl]pyrazol-3-yl]urea Formula: C19H26FN5OS MolecularWeight: 391.506043

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC)N1CCC(CC1)N2C(=CC=N2)NC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CC(CSC)N1CCC(CC1)N2C(=CC=N2)NC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C19H26FN5OS/c1-14(13-27-2)24-10-7-17(8-11-24)25-18(6-9-21-25)23-19(26)22-16-5-3-4-15(20)12-16/h3-6,9,12,14,17H,7-8,10-11,13H2,1-2H3,(H2,22,23,26)