[3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl] 3-methylsulfanylpropanoate

Systemtic Name: [3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl] 3-methylsulfanylpropanoate Openeye Name: [3-(5-thioxo-2H-tetrazol-1-yl)phenyl] 3-methylsulfanylpropanoate CAS Name: 3-(methylthio)propanoic acid [3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl] ester IUPAC Name: [3-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl] 3-methylsulfanylpropanoate Traditional Name: 3-(methylthio)propionic acid [3-(5-thioxo-2H-tetrazol-1-yl)phenyl] ester Formula: C11H12N4O2S2 MolecularWeight: 296.36858

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)OC1=CC=CC(=C1)N2C(=S)N=NN2

Isomeric SMILES

CSCCC(=O)OC1=CC=CC(=C1)N2C(=S)N=NN2

InChI

InChI=1S/C11H12N4O2S2/c1-19-6-5-10(16)17-9-4-2-3-8(7-9)15-11(18)12-13-14-15/h2-4,7H,5-6H2,1H3,(H,12,14,18)