2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[2-nitro-4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-[2-nitro-4-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[1-(4-chlorophenyl)-5-tetrazolyl]thio]-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[1-(4-chlorophenyl)tetrazol-5-yl]thio]-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide Formula: C16H10ClF3N6O3S MolecularWeight: 458.80221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=NN=N2)SCC(=O)NC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=NN=N2)SCC(=O)NC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H10ClF3N6O3S/c17-10-2-4-11(5-3-10)25-15(22-23-24-25)30-8-14(27)21-12-6-1-9(16(18,19)20)7-13(12)26(28)29/h1-7H,8H2,(H,21,27)