N-[2-(furan-2-ylmethylsulfanyl)ethyl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-1-phenyl-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C18H16F3N3O2S MolecularWeight: 395.39875

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCSCC3=CC=CO3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NCCSCC3=CC=CO3)C(F)(F)F

InChI

InChI=1S/C18H16F3N3O2S/c19-18(20,21)16-15(11-23-24(16)13-5-2-1-3-6-13)17(25)22-8-10-27-12-14-7-4-9-26-14/h1-7,9,11H,8,10,12H2,(H,22,25)