2-[5-(3-fluorophenyl)-1,2,3,4-tetrazol-2-yl]-N-prop-2-ynyl-propanamide

Systemtic Name: 2-[5-(3-fluorophenyl)-1,2,3,4-tetrazol-2-yl]-N-prop-2-ynyl-propanamide Openeye Name: 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-prop-2-ynyl-propanamide CAS Name: 2-[5-(3-fluorophenyl)-2-tetrazolyl]-N-prop-2-ynylpropanamide IUPAC Name: 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-prop-2-ynylpropanamide Traditional Name: 2-[5-(3-fluorophenyl)tetrazol-2-yl]-N-propargyl-propionamide Formula: C13H12FN5O MolecularWeight: 273.265683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC#C)N1N=C(N=N1)C2=CC(=CC=C2)F

Isomeric SMILES

CC(C(=O)NCC#C)N1N=C(N=N1)C2=CC(=CC=C2)F

InChI

InChI=1S/C13H12FN5O/c1-3-7-15-13(20)9(2)19-17-12(16-18-19)10-5-4-6-11(14)8-10/h1,4-6,8-9H,7H2,2H3,(H,15,20)