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

Systemtic Name: 1-[3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-phenethyl-thiourea Openeye Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-phenethyl-thiourea CAS Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]propyl]-3-phenethylthiourea IUPAC Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-phenethylthiourea Traditional Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-phenethyl-thiourea Formula: C19H22BrF3N4S MolecularWeight: 475.36899

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=NN2CCCNC(=S)NCCC3=CC=CC=C3)C(F)(F)F)Br

Isomeric SMILES

C1CC1C2=C(C(=NN2CCCNC(=S)NCCC3=CC=CC=C3)C(F)(F)F)Br

InChI

InChI=1S/C19H22BrF3N4S/c20-15-16(14-7-8-14)27(26-17(15)19(21,22)23)12-4-10-24-18(28)25-11-9-13-5-2-1-3-6-13/h1-3,5-6,14H,4,7-12H2,(H2,24,25,28)