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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NC2=CN(N=C2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C1CCC(C1)NC(=S)NC2=CN(N=C2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H18ClFN4S/c17-15-7-12(18)6-5-11(15)9-22-10-14(8-19-22)21-16(23)20-13-3-1-2-4-13/h5-8,10,13H,1-4,9H2,(H2,20,21,23)