4-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-nitro-benzamide

Systemtic Name: 4-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-nitro-benzamide Openeye Name: 4-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[1-(4-chlorophenyl)-5-tetrazolyl]thio]-3-nitrobenzamide IUPAC Name: 4-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[1-(4-chlorophenyl)tetrazol-5-yl]thio]-3-nitro-benzamide Formula: C14H9ClN6O3S MolecularWeight: 376.77766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=NN=N2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=NN=N2)SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H9ClN6O3S/c15-9-2-4-10(5-3-9)20-14(17-18-19-20)25-12-6-1-8(13(16)22)7-11(12)21(23)24/h1-7H,(H2,16,22)