N-cycloheptyl-2-[[4-(2-fluorophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-cycloheptyl-2-[[4-(2-fluorophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-cycloheptyl-2-[[4-(2-fluorophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-cycloheptyl-2-[[4-(2-fluorophenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-cycloheptyl-2-[[4-(2-fluorophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-cycloheptyl-2-[[4-(2-fluorophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H24FN5OS MolecularWeight: 425.522263

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3F)C4=CN=CC=C4

Isomeric SMILES

C1CCCC(CC1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3F)C4=CN=CC=C4

InChI

InChI=1S/C22H24FN5OS/c23-18-11-5-6-12-19(18)28-21(16-8-7-13-24-14-16)26-27-22(28)30-15-20(29)25-17-9-3-1-2-4-10-17/h5-8,11-14,17H,1-4,9-10,15H2,(H,25,29)