1-methyl-3-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)-5-(trifluoromethyl)pyrazole

Systemtic Name: 1-methyl-3-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)-5-(trifluoromethyl)pyrazole Openeye Name: 1-methyl-3-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)-5-(trifluoromethyl)pyrazole CAS Name: 1-methyl-3-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]-5-(trifluoromethyl)pyrazole IUPAC Name: 1-methyl-3-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)-5-(trifluoromethyl)pyrazole Traditional Name: 1-methyl-3-(5-pyrrolidinosulfonyl-2-thienyl)-5-(trifluoromethyl)pyrazole Formula: C13H14F3N3O2S2 MolecularWeight: 365.39437

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C2=CC=C(S2)S(=O)(=O)N3CCCC3)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=N1)C2=CC=C(S2)S(=O)(=O)N3CCCC3)C(F)(F)F

InChI

InChI=1S/C13H14F3N3O2S2/c1-18-11(13(14,15)16)8-9(17-18)10-4-5-12(22-10)23(20,21)19-6-2-3-7-19/h4-5,8H,2-3,6-7H2,1H3