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

Systemtic Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]propanamide Openeye Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]propanamide CAS Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-[(4-fluorophenyl)methyl]propanamide IUPAC Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-fluorophenyl)methyl]propanamide Traditional Name: 2-[(5-cyclopentyl-1H-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:

CC(C(=O)NCC1=CC=C(C=C1)F)SC2=NNC(=N2)C3CCCC3

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)F)SC2=NNC(=N2)C3CCCC3

InChI

InChI=1S/C17H21FN4OS/c1-11(16(23)19-10-12-6-8-14(18)9-7-12)24-17-20-15(21-22-17)13-4-2-3-5-13/h6-9,11,13H,2-5,10H2,1H3,(H,19,23)(H,20,21,22)