2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[(1-methyltetrazol-5-yl)sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[(1-methyl-5-tetrazolyl)thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[(1-methyltetrazol-5-yl)sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[(1-methyltetrazol-5-yl)thio]methyl]isoindoline-1,3-quinone Formula: C11H9N5O2S MolecularWeight: 275.28646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CN1C(=NN=N1)SCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C11H9N5O2S/c1-15-11(12-13-14-15)19-6-16-9(17)7-4-2-3-5-8(7)10(16)18/h2-5H,6H2,1H3