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

Systemtic Name: 2-[[4-(cyclopentylmethyl)-5-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-(cyclopentylmethyl)-5-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-(cyclopentylmethyl)-5-cyclopropyl-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-(cyclopentylmethyl)-5-cyclopropyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-(cyclopentylmethyl)-5-cyclopropyl-1,2,4-triazol-3-yl]thio]acetic acid Formula: C13H19N3O2S MolecularWeight: 281.37386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CN2C(=NN=C2SCC(=O)O)C3CC3

Isomeric SMILES

C1CCC(C1)CN2C(=NN=C2SCC(=O)O)C3CC3

InChI

InChI=1S/C13H19N3O2S/c17-11(18)8-19-13-15-14-12(10-5-6-10)16(13)7-9-3-1-2-4-9/h9-10H,1-8H2,(H,17,18)