[(3-methylsulfanyl-1,2,4-triazol-1-yl)-phenyl-methyl] benzoate

Systemtic Name: [(3-methylsulfanyl-1,2,4-triazol-1-yl)-phenyl-methyl] benzoate Openeye Name: [(3-methylsulfanyl-1,2,4-triazol-1-yl)-phenyl-methyl] benzoate CAS Name: benzoic acid [[3-(methylthio)-1,2,4-triazol-1-yl]-phenylmethyl] ester IUPAC Name: [(3-methylsulfanyl-1,2,4-triazol-1-yl)-phenylmethyl] benzoate Traditional Name: benzoic acid [[3-(methylthio)-1,2,4-triazol-1-yl]-phenyl-methyl] ester Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C=N1)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=NN(C=N1)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H15N3O2S/c1-23-17-18-12-20(19-17)15(13-8-4-2-5-9-13)22-16(21)14-10-6-3-7-11-14/h2-12,15H,1H3