2-[3-[bis(fluoranyl)methyl]-4-bromanyl-5-methyl-pyrazol-1-yl]-N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)propanamide

Systemtic Name: 2-[3-[bis(fluoranyl)methyl]-4-bromanyl-5-methyl-pyrazol-1-yl]-N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)propanamide Openeye Name: 2-[4-bromo-3-(difluoromethyl)-5-methyl-pyrazol-1-yl]-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)propanamide CAS Name: 2-[4-bromo-3-(difluoromethyl)-5-methyl-1-pyrazolyl]-N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)propanamide IUPAC Name: 2-[4-bromo-3-(difluoromethyl)-5-methylpyrazol-1-yl]-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)propanamide Traditional Name: 2-[4-bromo-3-(difluoromethyl)-5-methyl-pyrazol-1-yl]-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)propionamide Formula: C16H17BrF2N4OS MolecularWeight: 431.298186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)C(C)N2C(=C(C(=N2)C(F)F)Br)C)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)C(C)N2C(=C(C(=N2)C(F)F)Br)C)C

InChI

InChI=1S/C16H17BrF2N4OS/c1-5-10-9(4)25-16(11(10)6-20)21-15(24)8(3)23-7(2)12(17)13(22-23)14(18)19/h8,14H,5H2,1-4H3,(H,21,24)