(2R)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-fluorophenyl)methyl]propanamide

Systemtic Name: (2R)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-fluorophenyl)methyl]propanamide Openeye Name: (2R)-2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-fluorophenyl)methyl]propanamide CAS Name: (2R)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-[(4-fluorophenyl)methyl]propanamide IUPAC Name: (2R)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(4-fluorophenyl)methyl]propanamide Traditional Name: (2R)-2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-(4-fluorobenzyl)propionamide Formula: C21H23FN4OS MolecularWeight: 398.496923

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NCC2=CC=C(C=C2)F)C3=CC=CC=C3C

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)NCC2=CC=C(C=C2)F)C3=CC=CC=C3C

InChI

InChI=1S/C21H23FN4OS/c1-4-26-19(18-8-6-5-7-14(18)2)24-25-21(26)28-15(3)20(27)23-13-16-9-11-17(22)12-10-16/h5-12,15H,4,13H2,1-3H3,(H,23,27)/t15-/m1/s1