2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl benzoate

Systemtic Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl benzoate Openeye Name: 2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl benzoate CAS Name: benzoic acid 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]ethyl ester IUPAC Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl benzoate Traditional Name: benzoic acid 2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]ethyl ester Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCCOC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCCOC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2S/c1-14-7-5-6-10-16(14)21-13-19-20-18(21)24-12-11-23-17(22)15-8-3-2-4-9-15/h2-10,13H,11-12H2,1H3