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

Systemtic Name: N-cycloheptyl-2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-cycloheptyl-2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-cycloheptyl-2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-cycloheptyl-2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-cycloheptyl-2-[[4-(4-fluorophenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C23H25FN4OS MolecularWeight: 424.534203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C23H25FN4OS/c24-18-12-14-20(15-13-18)28-22(17-8-4-3-5-9-17)26-27-23(28)30-16-21(29)25-19-10-6-1-2-7-11-19/h3-5,8-9,12-15,19H,1-2,6-7,10-11,16H2,(H,25,29)