N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(furan-2-ylmethyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(furan-2-ylmethyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(2-furylmethyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(2-furanylmethyl)-5-(2-pyrazinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(furan-2-ylmethyl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[[4-(2-furfuryl)-5-pyrazin-2-yl-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H14F6N6O2S MolecularWeight: 528.430279

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=NN=C2SCC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=NC=CN=C4

Isomeric SMILES

C1=COC(=C1)CN2C(=NN=C2SCC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=NC=CN=C4

InChI

InChI=1S/C21H14F6N6O2S/c22-20(23,24)12-6-13(21(25,26)27)8-14(7-12)30-17(34)11-36-19-32-31-18(16-9-28-3-4-29-16)33(19)10-15-2-1-5-35-15/h1-9H,10-11H2,(H,30,34)