(2R)-N-(3-chloranyl-4-fluoranyl-phenyl)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: (2R)-N-(3-chloranyl-4-fluoranyl-phenyl)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2R)-N-(3-chloro-4-fluoro-phenyl)-2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-(3-chloro-4-fluorophenyl)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-N-(3-chloro-4-fluorophenyl)-2-[[4-ethyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2R)-N-(3-chloro-4-fluoro-phenyl)-2-[[4-ethyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H20ClFN4OS MolecularWeight: 418.915403

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NC2=CC(=C(C=C2)F)Cl)C3=CC=CC=C3C

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)NC2=CC(=C(C=C2)F)Cl)C3=CC=CC=C3C

InChI

InChI=1S/C20H20ClFN4OS/c1-4-26-18(15-8-6-5-7-12(15)2)24-25-20(26)28-13(3)19(27)23-14-9-10-17(22)16(21)11-14/h5-11,13H,4H2,1-3H3,(H,23,27)/t13-/m1/s1