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

Systemtic Name: 3-[[4-azanyl-5-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[[4-amino-5-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 3-[[4-amino-5-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[[4-amino-5-[(2-fluorophenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 3-[[4-amino-5-(2-fluorobenzyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C12H14FN5OS MolecularWeight: 295.335863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=NN=C(N2N)SCCC(=O)N)F

Isomeric SMILES

C1=CC=C(C(=C1)CC2=NN=C(N2N)SCCC(=O)N)F

InChI

InChI=1S/C12H14FN5OS/c13-9-4-2-1-3-8(9)7-11-16-17-12(18(11)15)20-6-5-10(14)19/h1-4H,5-7,15H2,(H2,14,19)