ethyl 4-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)propyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)propyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(5-thioxo-2H-tetrazol-1-yl)propyl]piperazine-1-carboxylate CAS Name: 4-[3-(5-sulfanylidene-2H-tetrazol-1-yl)propyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(5-sulfanylidene-2H-tetrazol-1-yl)propyl]piperazine-1-carboxylate Traditional Name: 4-[3-(5-thioxo-2H-tetrazol-1-yl)propyl]piperazine-1-carboxylic acid ethyl ester Formula: C11H20N6O2S MolecularWeight: 300.3805

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CCCN2C(=S)N=NN2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CCCN2C(=S)N=NN2

InChI

InChI=1S/C11H20N6O2S/c1-2-19-11(18)16-8-6-15(7-9-16)4-3-5-17-10(20)12-13-14-17/h2-9H2,1H3,(H,12,14,20)