2-[[5-cyclopropyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-cyclopropyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-cyclopropyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-cyclopropyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[5-cyclopropyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-cyclopropyl-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetate Formula: C14H14N3O3S- MolecularWeight: 304.34426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)[O-])C3CC3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)[O-])C3CC3

InChI

InChI=1S/C14H15N3O3S/c1-20-11-6-4-10(5-7-11)17-13(9-2-3-9)15-16-14(17)21-8-12(18)19/h4-7,9H,2-3,8H2,1H3,(H,18,19)/p-1