[5-(2-phenylsulfanylthiophen-3-yl)-1,2,3,4-tetrazol-1-yl] ethanoate

Systemtic Name: [5-(2-phenylsulfanylthiophen-3-yl)-1,2,3,4-tetrazol-1-yl] ethanoate Openeye Name: [5-(2-phenylsulfanyl-3-thienyl)tetrazol-1-yl] acetate CAS Name: acetic acid [5-[2-(phenylthio)-3-thiophenyl]-1-tetrazolyl] ester IUPAC Name: [5-(2-phenylsulfanylthiophen-3-yl)tetrazol-1-yl] acetate Traditional Name: acetic acid [5-[2-(phenylthio)-3-thienyl]tetrazol-1-yl] ester Formula: C13H10N4O2S2 MolecularWeight: 318.3741

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON1C(=NN=N1)C2=C(SC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(=O)ON1C(=NN=N1)C2=C(SC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C13H10N4O2S2/c1-9(18)19-17-12(14-15-16-17)11-7-8-20-13(11)21-10-5-3-2-4-6-10/h2-8H,1H3