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

Systemtic Name: 1-(4-bromophenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea Openeye Name: 1-(4-bromophenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea CAS Name: 1-(4-bromophenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]propyl]thiourea IUPAC Name: 1-(4-bromophenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea Traditional Name: 1-(4-bromophenyl)-3-[3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]thiourea Formula: C17H18BrF3N4S MolecularWeight: 447.31583

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2CCCNC(=S)NC3=CC=C(C=C3)Br)C(F)(F)F

Isomeric SMILES

C1CC1C2=CC(=NN2CCCNC(=S)NC3=CC=C(C=C3)Br)C(F)(F)F

InChI

InChI=1S/C17H18BrF3N4S/c18-12-4-6-13(7-5-12)23-16(26)22-8-1-9-25-14(11-2-3-11)10-15(24-25)17(19,20)21/h4-7,10-11H,1-3,8-9H2,(H2,22,23,26)