propan-2-yl 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: propan-2-yl 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: isopropyl 2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetic acid isopropyl ester Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCC(=O)OC(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCC(=O)OC(C)C

InChI

InChI=1S/C14H17N3O2S/c1-10(2)19-13(18)8-20-14-16-15-9-17(14)12-7-5-4-6-11(12)3/h4-7,9-10H,8H2,1-3H3