5-nitro-2-[[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]benzenecarbonitrile

Systemtic Name: 5-nitro-2-[[1-(thiophen-2-ylmethyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]benzenecarbonitrile Openeye Name: 5-nitro-2-[1-(2-thienylmethyl)tetrazol-5-yl]sulfanyl-benzonitrile CAS Name: 5-nitro-2-[[1-(thiophen-2-ylmethyl)-5-tetrazolyl]thio]benzonitrile IUPAC Name: 5-nitro-2-[1-(thiophen-2-ylmethyl)tetrazol-5-yl]sulfanylbenzonitrile Traditional Name: 5-nitro-2-[[1-(2-thenyl)tetrazol-5-yl]thio]benzonitrile Formula: C13H8N6O2S2 MolecularWeight: 344.37162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CN2C(=NN=N2)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CSC(=C1)CN2C(=NN=N2)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C13H8N6O2S2/c14-7-9-6-10(19(20)21)3-4-12(9)23-13-15-16-17-18(13)8-11-2-1-5-22-11/h1-6H,8H2