4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-2-nitro-benzoyl chloride

Systemtic Name: 4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-2-nitro-benzoyl chloride Openeye Name: 4-[(1-methyltetrazol-5-yl)sulfanylmethyl]-2-nitro-benzoyl chloride CAS Name: 4-[[(1-methyl-5-tetrazolyl)thio]methyl]-2-nitrobenzoyl chloride IUPAC Name: 4-[(1-methyltetrazol-5-yl)sulfanylmethyl]-2-nitrobenzoyl chloride Traditional Name: 4-[[(1-methyltetrazol-5-yl)thio]methyl]-2-nitro-benzoyl chloride Formula: C10H8ClN5O3S MolecularWeight: 313.72022

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=CC(=C(C=C2)C(=O)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NN=N1)SCC2=CC(=C(C=C2)C(=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H8ClN5O3S/c1-15-10(12-13-14-15)20-5-6-2-3-7(9(11)17)8(4-6)16(18)19/h2-4H,5H2,1H3