2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-(4-fluorobenzyl)acetamide Formula: C17H22FN5OS MolecularWeight: 363.452883

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N)SCC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2N)SCC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H22FN5OS/c18-14-8-6-12(7-9-14)10-20-15(24)11-25-17-22-21-16(23(17)19)13-4-2-1-3-5-13/h6-9,13H,1-5,10-11,19H2,(H,20,24)