3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-sulfanylethyl)propanamide

Systemtic Name: 3-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-sulfanylethyl)propanamide Openeye Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-sulfanylethyl)propanamide CAS Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-N-(2-mercaptoethyl)propanamide IUPAC Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-sulfanylethyl)propanamide Traditional Name: 3-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-mercaptoethyl)propionamide Formula: C12H15BrF3N3OS MolecularWeight: 386.23121

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=NN2CCC(=O)NCCS)C(F)(F)F)Br

Isomeric SMILES

C1CC1C2=C(C(=NN2CCC(=O)NCCS)C(F)(F)F)Br

InChI

InChI=1S/C12H15BrF3N3OS/c13-9-10(7-1-2-7)19(18-11(9)12(14,15)16)5-3-8(20)17-4-6-21/h7,21H,1-6H2,(H,17,20)