2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-nitrophenyl)ethanone

Systemtic Name: 2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-nitrophenyl)ethanone Openeye Name: 2-(1-methyltetrazol-5-yl)sulfanyl-1-(4-nitrophenyl)ethanone CAS Name: 2-[(1-methyl-5-tetrazolyl)thio]-1-(4-nitrophenyl)ethanone IUPAC Name: 2-(1-methyltetrazol-5-yl)sulfanyl-1-(4-nitrophenyl)ethanone Traditional Name: 2-[(1-methyltetrazol-5-yl)thio]-1-(4-nitrophenyl)ethanone Formula: C10H9N5O3S MolecularWeight: 279.27516

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NN=N1)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C10H9N5O3S/c1-14-10(11-12-13-14)19-6-9(16)7-2-4-8(5-3-7)15(17)18/h2-5H,6H2,1H3