1-(4-fluorophenyl)-3-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]urea

Systemtic Name: 1-(4-fluorophenyl)-3-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]urea Openeye Name: 1-(4-fluorophenyl)-3-[1-[(2-pyrimidin-2-ylthiazol-4-yl)methyl]-4-piperidyl]urea CAS Name: 1-(4-fluorophenyl)-3-[1-[[2-(2-pyrimidinyl)-4-thiazolyl]methyl]-4-piperidinyl]urea IUPAC Name: 1-(4-fluorophenyl)-3-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]urea Traditional Name: 1-(4-fluorophenyl)-3-[1-[[2-(2-pyrimidyl)thiazol-4-yl]methyl]-4-piperidyl]urea Formula: C20H21FN6OS MolecularWeight: 412.483743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)NC2=CC=C(C=C2)F)CC3=CSC(=N3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1NC(=O)NC2=CC=C(C=C2)F)CC3=CSC(=N3)C4=NC=CC=N4

InChI

InChI=1S/C20H21FN6OS/c21-14-2-4-15(5-3-14)25-20(28)26-16-6-10-27(11-7-16)12-17-13-29-19(24-17)18-22-8-1-9-23-18/h1-5,8-9,13,16H,6-7,10-12H2,(H2,25,26,28)