5-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]-1-cyclohexyl-1,2,3,4-tetrazole

Systemtic Name: 5-[(2-chloranyl-6-nitro-phenyl)methylsulfanyl]-1-cyclohexyl-1,2,3,4-tetrazole Openeye Name: 5-[(2-chloro-6-nitro-phenyl)methylsulfanyl]-1-cyclohexyl-tetrazole CAS Name: 5-[(2-chloro-6-nitrophenyl)methylthio]-1-cyclohexyltetrazole IUPAC Name: 5-[(2-chloro-6-nitrophenyl)methylsulfanyl]-1-cyclohexyltetrazole Traditional Name: 5-[(2-chloro-6-nitro-benzyl)thio]-1-cyclohexyl-tetrazole Formula: C14H16ClN5O2S MolecularWeight: 353.82714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)SCC3=C(C=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)SCC3=C(C=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H16ClN5O2S/c15-12-7-4-8-13(20(21)22)11(12)9-23-14-16-17-18-19(14)10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9H2