1-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-cyclopentyl-thiourea

Systemtic Name: 1-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-4-yl]-3-cyclopentyl-thiourea Openeye Name: 1-[1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-4-yl]-3-cyclopentyl-thiourea CAS Name: 1-[1-[(2-chloro-6-fluorophenyl)methyl]-4-pyrazolyl]-3-cyclopentylthiourea IUPAC Name: 1-[1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-4-yl]-3-cyclopentylthiourea Traditional Name: 1-[1-(2-chloro-6-fluoro-benzyl)pyrazol-4-yl]-3-cyclopentyl-thiourea Formula: C16H18ClFN4S MolecularWeight: 352.857323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NC2=CN(N=C2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CCC(C1)NC(=S)NC2=CN(N=C2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H18ClFN4S/c17-14-6-3-7-15(18)13(14)10-22-9-12(8-19-22)21-16(23)20-11-4-1-2-5-11/h3,6-9,11H,1-2,4-5,10H2,(H2,20,21,23)