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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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