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

Systemtic Name: 2-[[5-cyclopropyl-4-(4-methylcyclohexyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-cyclopropyl-4-(4-methylcyclohexyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[5-cyclopropyl-4-(4-methylcyclohexyl)-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[5-cyclopropyl-4-(4-methylcyclohexyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[5-cyclopropyl-4-(4-methylcyclohexyl)-1,2,4-triazol-3-yl]thio]acetate Formula: C14H20N3O2S- MolecularWeight: 294.3925

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N2C(=NN=C2SCC(=O)[O-])C3CC3

Isomeric SMILES

CC1CCC(CC1)N2C(=NN=C2SCC(=O)[O-])C3CC3

InChI

InChI=1S/C14H21N3O2S/c1-9-2-6-11(7-3-9)17-13(10-4-5-10)15-16-14(17)20-8-12(18)19/h9-11H,2-8H2,1H3,(H,18,19)/p-1