2-[2-[5-(4-methylsulfanylphenyl)-1,2,3,4-tetrazol-2-yl]ethanoylamino]benzoate

Systemtic Name: 2-[2-[5-(4-methylsulfanylphenyl)-1,2,3,4-tetrazol-2-yl]ethanoylamino]benzoate Openeye Name: 2-[[2-[5-(4-methylsulfanylphenyl)tetrazol-2-yl]acetyl]amino]benzoate CAS Name: 2-[[2-[5-[4-(methylthio)phenyl]-2-tetrazolyl]-1-oxoethyl]amino]benzoate IUPAC Name: 2-[[2-[5-(4-methylsulfanylphenyl)tetrazol-2-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[5-[4-(methylthio)phenyl]tetrazol-2-yl]acetyl]amino]benzoate Formula: C17H14N5O3S- MolecularWeight: 368.38976

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)NC3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NN(N=N2)CC(=O)NC3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C17H15N5O3S/c1-26-12-8-6-11(7-9-12)16-19-21-22(20-16)10-15(23)18-14-5-3-2-4-13(14)17(24)25/h2-9H,10H2,1H3,(H,18,23)(H,24,25)/p-1