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

Systemtic Name: 1-[3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]propyl]-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-[3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-3-(4-sulfamoylphenyl)thiourea Formula: C17H19BrF3N5O2S2 MolecularWeight: 526.39427

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19BrF3N5O2S2/c18-13-14(10-2-3-10)26(25-15(13)17(19,20)21)9-1-8-23-16(29)24-11-4-6-12(7-5-11)30(22,27)28/h4-7,10H,1-3,8-9H2,(H2,22,27,28)(H2,23,24,29)