1-thiophen-2-yl-4-[[3-(trifluoromethyl)phenyl]methyl]-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-thiophen-2-yl-4-[[3-(trifluoromethyl)phenyl]methyl]-1,2,3,4-tetrazol-5-one Openeye Name: 1-(2-thienyl)-4-[[3-(trifluoromethyl)phenyl]methyl]tetrazol-5-one CAS Name: 1-thiophen-2-yl-4-[[3-(trifluoromethyl)phenyl]methyl]-5-tetrazolone IUPAC Name: 1-thiophen-2-yl-4-[[3-(trifluoromethyl)phenyl]methyl]tetrazol-5-one Traditional Name: 1-(2-thienyl)-4-[3-(trifluoromethyl)benzyl]tetrazol-5-one Formula: C13H9F3N4OS MolecularWeight: 326.29697

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CN2C(=O)N(N=N2)C3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CN2C(=O)N(N=N2)C3=CC=CS3

InChI

InChI=1S/C13H9F3N4OS/c14-13(15,16)10-4-1-3-9(7-10)8-19-12(21)20(18-17-19)11-5-2-6-22-11/h1-7H,8H2