1-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-(1-methyl-5-piperidin-1-ylcarbonyl-pyrazol-4-yl)thiourea

Systemtic Name: 1-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-(1-methyl-5-piperidin-1-ylcarbonyl-pyrazol-4-yl)thiourea Openeye Name: 1-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]thiourea CAS Name: 1-[1-[(2-fluorophenyl)methyl]-3-pyrazolyl]-3-[1-methyl-5-[oxo(1-piperidinyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-[1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]thiourea Traditional Name: 1-[1-(2-fluorobenzyl)pyrazol-3-yl]-3-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]thiourea Formula: C21H24FN7OS MolecularWeight: 441.524963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)NC(=S)NC2=NN(C=C2)CC3=CC=CC=C3F)C(=O)N4CCCCC4

Isomeric SMILES

CN1C(=C(C=N1)NC(=S)NC2=NN(C=C2)CC3=CC=CC=C3F)C(=O)N4CCCCC4

InChI

InChI=1S/C21H24FN7OS/c1-27-19(20(30)28-10-5-2-6-11-28)17(13-23-27)24-21(31)25-18-9-12-29(26-18)14-15-7-3-4-8-16(15)22/h3-4,7-9,12-13H,2,5-6,10-11,14H2,1H3,(H2,24,25,26,31)