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

Systemtic Name: 2-[[1-(2-thiophen-2-ylethyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[[1-[2-(2-thienyl)ethyl]tetrazol-5-yl]sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[[1-(2-thiophen-2-ylethyl)-5-tetrazolyl]thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[[1-(2-thiophen-2-ylethyl)tetrazol-5-yl]sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[[1-[2-(2-thienyl)ethyl]tetrazol-5-yl]thio]methyl]isoindoline-1,3-quinone Formula: C16H13N5O2S2 MolecularWeight: 371.43672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=NN=NN3CCC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CSC3=NN=NN3CCC4=CC=CS4

InChI

InChI=1S/C16H13N5O2S2/c22-14-12-5-1-2-6-13(12)15(23)20(14)10-25-16-17-18-19-21(16)8-7-11-4-3-9-24-11/h1-6,9H,7-8,10H2