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

Systemtic Name: 2-[[4-cyclopropyl-5-(dimethylamino)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-cyclopropyl-5-(dimethylamino)-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-cyclopropyl-5-(dimethylamino)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-cyclopropyl-5-(dimethylamino)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-cyclopropyl-5-(dimethylamino)-1,2,4-triazol-3-yl]thio]acetic acid Formula: C9H14N4O2S MolecularWeight: 242.29806

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NN=C(N1C2CC2)SCC(=O)O

Isomeric SMILES

CN(C)C1=NN=C(N1C2CC2)SCC(=O)O

InChI

InChI=1S/C9H14N4O2S/c1-12(2)8-10-11-9(16-5-7(14)15)13(8)6-3-4-6/h6H,3-5H2,1-2H3,(H,14,15)