1-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]-3-(1-methyl-5-piperidin-1-ylcarbonyl-pyrazol-4-yl)thiourea

Systemtic Name: 1-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]-3-(1-methyl-5-piperidin-1-ylcarbonyl-pyrazol-4-yl)thiourea Openeye Name: 1-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]-3-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]thiourea CAS Name: 1-[1-[(4-fluorophenyl)methyl]-4-pyrazolyl]-3-[1-methyl-5-[oxo(1-piperidinyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-[1-[(4-fluorophenyl)methyl]pyrazol-4-yl]-3-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]thiourea Traditional Name: 1-[1-(4-fluorobenzyl)pyrazol-4-yl]-3-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]thiourea Formula: C21H24FN7OS MolecularWeight: 441.524963

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)NC(=S)NC2=CN(N=C2)CC3=CC=C(C=C3)F)C(=O)N4CCCCC4

Isomeric SMILES

CN1C(=C(C=N1)NC(=S)NC2=CN(N=C2)CC3=CC=C(C=C3)F)C(=O)N4CCCCC4

InChI

InChI=1S/C21H24FN7OS/c1-27-19(20(30)28-9-3-2-4-10-28)18(12-23-27)26-21(31)25-17-11-24-29(14-17)13-15-5-7-16(22)8-6-15/h5-8,11-12,14H,2-4,9-10,13H2,1H3,(H2,25,26,31)