5-[(4-chloranyl-3-nitro-phenyl)methylsulfanyl]-1-methyl-1,2,3,4-tetrazole

Systemtic Name: 5-[(4-chloranyl-3-nitro-phenyl)methylsulfanyl]-1-methyl-1,2,3,4-tetrazole Openeye Name: 5-[(4-chloro-3-nitro-phenyl)methylsulfanyl]-1-methyl-tetrazole CAS Name: 5-[(4-chloro-3-nitrophenyl)methylthio]-1-methyltetrazole IUPAC Name: 5-[(4-chloro-3-nitrophenyl)methylsulfanyl]-1-methyltetrazole Traditional Name: 5-[(4-chloro-3-nitro-benzyl)thio]-1-methyl-tetrazole Formula: C9H8ClN5O2S MolecularWeight: 285.71012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8ClN5O2S/c1-14-9(11-12-13-14)18-5-6-2-3-7(10)8(4-6)15(16)17/h2-4H,5H2,1H3