1-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-cyclohexyl-thiourea

Systemtic Name: 1-[4-bromanyl-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-cyclohexyl-thiourea Openeye Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-cyclohexyl-thiourea CAS Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]-3-pyrazolyl]-3-cyclohexylthiourea IUPAC Name: 1-[4-bromo-1-[(2-fluorophenyl)methyl]pyrazol-3-yl]-3-cyclohexylthiourea Traditional Name: 1-[4-bromo-1-(2-fluorobenzyl)pyrazol-3-yl]-3-cyclohexyl-thiourea Formula: C17H20BrFN4S MolecularWeight: 411.334903

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=NN(C=C2Br)CC3=CC=CC=C3F

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=NN(C=C2Br)CC3=CC=CC=C3F

InChI

InChI=1S/C17H20BrFN4S/c18-14-11-23(10-12-6-4-5-9-15(12)19)22-16(14)21-17(24)20-13-7-2-1-3-8-13/h4-6,9,11,13H,1-3,7-8,10H2,(H2,20,21,22,24)