phenyl 4-(5-chloranylsulfanyl-1,2,3,4-tetrazol-2-yl)benzoate

Systemtic Name: phenyl 4-(5-chloranylsulfanyl-1,2,3,4-tetrazol-2-yl)benzoate Openeye Name: phenyl 4-(5-chlorosulfanyltetrazol-2-yl)benzoate CAS Name: 4-[5-(chlorothio)-2-tetrazolyl]benzoic acid phenyl ester IUPAC Name: phenyl 4-(5-chlorosulfanyltetrazol-2-yl)benzoate Traditional Name: 4-[5-(chlorothio)tetrazol-2-yl]benzoic acid phenyl ester Formula: C14H9ClN4O2S MolecularWeight: 332.76486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N3N=C(N=N3)SCl

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N3N=C(N=N3)SCl

InChI

InChI=1S/C14H9ClN4O2S/c15-22-14-16-18-19(17-14)11-8-6-10(7-9-11)13(20)21-12-4-2-1-3-5-12/h1-9H