2-[[5-cyclopropyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[5-cyclopropyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-cyclopropyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[5-cyclopropyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[5-cyclopropyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-cyclopropyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetic acid Formula: C14H15N3O2S MolecularWeight: 289.3528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)O)C3CC3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)O)C3CC3

InChI

InChI=1S/C14H15N3O2S/c1-9-2-6-11(7-3-9)17-13(10-4-5-10)15-16-14(17)20-8-12(18)19/h2-3,6-7,10H,4-5,8H2,1H3,(H,18,19)