ethyl 3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: ethyl 3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: ethyl 3-(5-thioxo-2H-tetrazol-1-yl)benzoate CAS Name: 3-(5-sulfanylidene-2H-tetrazol-1-yl)benzoic acid ethyl ester IUPAC Name: ethyl 3-(5-sulfanylidene-2H-tetrazol-1-yl)benzoate Traditional Name: 3-(5-thioxo-2H-tetrazol-1-yl)benzoic acid ethyl ester Formula: C10H10N4O2S MolecularWeight: 250.277

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N2C(=S)N=NN2

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N2C(=S)N=NN2

InChI

InChI=1S/C10H10N4O2S/c1-2-16-9(15)7-4-3-5-8(6-7)14-10(17)11-12-13-14/h3-6H,2H2,1H3,(H,11,13,17)