phenyl 2-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)ethanoate

Systemtic Name: phenyl 2-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)ethanoate Openeye Name: phenyl 2-(5-thioxo-2H-tetrazol-1-yl)acetate CAS Name: 2-(5-sulfanylidene-2H-tetrazol-1-yl)acetic acid phenyl ester IUPAC Name: phenyl 2-(5-sulfanylidene-2H-tetrazol-1-yl)acetate Traditional Name: 2-(5-thioxo-2H-tetrazol-1-yl)acetic acid phenyl ester Formula: C9H8N4O2S MolecularWeight: 236.25042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)CN2C(=S)N=NN2

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)CN2C(=S)N=NN2

InChI

InChI=1S/C9H8N4O2S/c14-8(6-13-9(16)10-11-12-13)15-7-4-2-1-3-5-7/h1-5H,6H2,(H,10,12,16)