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

Systemtic Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]propanamide Openeye Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]propanamide CAS Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-[(4-fluorophenyl)methyl]propanamide IUPAC Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]propanamide Traditional Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-(4-fluorobenzyl)propionamide Formula: C17H21FN4OS MolecularWeight: 348.438243

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NCC2=CC=C(C=C2)F)C3CC3

Isomeric SMILES

CCN1C(=NN=C1SC(C)C(=O)NCC2=CC=C(C=C2)F)C3CC3

InChI

InChI=1S/C17H21FN4OS/c1-3-22-15(13-6-7-13)20-21-17(22)24-11(2)16(23)19-10-12-4-8-14(18)9-5-12/h4-5,8-9,11,13H,3,6-7,10H2,1-2H3,(H,19,23)