4-[5-[(4-methoxyphenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]benzoate

Systemtic Name: 4-[5-[(4-methoxyphenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]benzoate Openeye Name: 4-[5-[(4-methoxyphenyl)methylsulfanyl]tetrazol-1-yl]benzoate CAS Name: 4-[5-[(4-methoxyphenyl)methylthio]-1-tetrazolyl]benzoate IUPAC Name: 4-[5-[(4-methoxyphenyl)methylsulfanyl]tetrazol-1-yl]benzoate Traditional Name: 4-[5-(p-anisylthio)tetrazol-1-yl]benzoate Formula: C16H13N4O3S- MolecularWeight: 341.36442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=NN2C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=NN2C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C16H14N4O3S/c1-23-14-8-2-11(3-9-14)10-24-16-17-18-19-20(16)13-6-4-12(5-7-13)15(21)22/h2-9H,10H2,1H3,(H,21,22)/p-1