ethyl [1-[3-(propanethioylamino)phenyl]-1,2,3,4-tetrazol-5-yl]sulfanylmethanoate

Systemtic Name: ethyl [1-[3-(propanethioylamino)phenyl]-1,2,3,4-tetrazol-5-yl]sulfanylmethanoate Openeye Name: ethyl [1-[3-(propanethioylamino)phenyl]tetrazol-5-yl]sulfanylformate CAS Name: [[1-[3-(1-sulfanylidenepropylamino)phenyl]-5-tetrazolyl]thio]formic acid ethyl ester IUPAC Name: ethyl [1-[3-(propanethioylamino)phenyl]tetrazol-5-yl]sulfanylformate Traditional Name: [[1-[3-(propanethioylamino)phenyl]tetrazol-5-yl]thio]formic acid ethyl ester Formula: C13H15N5O2S2 MolecularWeight: 337.4205

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=S)NC1=CC=CC(=C1)N2C(=NN=N2)SC(=O)OCC

Isomeric SMILES

CCC(=S)NC1=CC=CC(=C1)N2C(=NN=N2)SC(=O)OCC

InChI

InChI=1S/C13H15N5O2S2/c1-3-11(21)14-9-6-5-7-10(8-9)18-12(15-16-17-18)22-13(19)20-4-2/h5-8H,3-4H2,1-2H3,(H,14,21)