S-(2-phenyl-1,2,3,4-tetrazol-5-yl) benzenecarbothioate

Systemtic Name: S-(2-phenyl-1,2,3,4-tetrazol-5-yl) benzenecarbothioate Openeye Name: S-(2-phenyltetrazol-5-yl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-(2-phenyl-5-tetrazolyl) ester IUPAC Name: S-(2-phenyltetrazol-5-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(2-phenyltetrazol-5-yl) ester Formula: C14H10N4OS MolecularWeight: 282.3204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC2=NN(N=N2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC2=NN(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C14H10N4OS/c19-13(11-7-3-1-4-8-11)20-14-15-17-18(16-14)12-9-5-2-6-10-12/h1-10H