2-[[4-(cyclopropylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[4-(cyclopropylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: 2-[[4-(cyclopropylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(cyclopropylmethyl)-1,2,4-triazol-3-yl]thio]acetate IUPAC Name: 2-[[4-(cyclopropylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(cyclopropylmethyl)-1,2,4-triazol-3-yl]thio]acetate Formula: C8H10N3O2S- MolecularWeight: 212.2489

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C=NN=C2SCC(=O)[O-]

Isomeric SMILES

C1CC1CN2C=NN=C2SCC(=O)[O-]

InChI

InChI=1S/C8H11N3O2S/c12-7(13)4-14-8-10-9-5-11(8)3-6-1-2-6/h5-6H,1-4H2,(H,12,13)/p-1