1-[3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-[3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(2-furylmethyl)thiourea CAS Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]propyl]-3-(2-furanylmethyl)thiourea IUPAC Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(2-furfuryl)thiourea Formula: C16H18BrF3N4OS MolecularWeight: 451.30453

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=NN2CCCNC(=S)NCC3=CC=CO3)C(F)(F)F)Br

Isomeric SMILES

C1CC1C2=C(C(=NN2CCCNC(=S)NCC3=CC=CO3)C(F)(F)F)Br

InChI

InChI=1S/C16H18BrF3N4OS/c17-12-13(10-4-5-10)24(23-14(12)16(18,19)20)7-2-6-21-15(26)22-9-11-3-1-8-25-11/h1,3,8,10H,2,4-7,9H2,(H2,21,22,26)