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

Systemtic Name: N-cyclohexyl-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: N-cyclohexyl-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]acetamide CAS Name: N-cyclohexyl-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: N-cyclohexyl-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: N-cyclohexyl-2-[(5-cyclopropyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-(4-fluorobenzyl)acetamide Formula: C21H27FN4OS MolecularWeight: 402.528683

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N(CC2=CC=C(C=C2)F)C3CCCCC3)C4CC4

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N(CC2=CC=C(C=C2)F)C3CCCCC3)C4CC4

InChI

InChI=1S/C21H27FN4OS/c1-25-20(16-9-10-16)23-24-21(25)28-14-19(27)26(18-5-3-2-4-6-18)13-15-7-11-17(22)12-8-15/h7-8,11-12,16,18H,2-6,9-10,13-14H2,1H3