2-[[4-(3-oxidanylpropyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[4-(3-oxidanylpropyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-(3-hydroxypropyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-(3-hydroxypropyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-(3-hydroxypropyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-(3-hydroxypropyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C12H15N5O2S MolecularWeight: 293.3448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN=C(N2CCCO)SCC(=O)N

Isomeric SMILES

C1=CC(=CN=C1)C2=NN=C(N2CCCO)SCC(=O)N

InChI

InChI=1S/C12H15N5O2S/c13-10(19)8-20-12-16-15-11(17(12)5-2-6-18)9-3-1-4-14-7-9/h1,3-4,7,18H,2,5-6,8H2,(H2,13,19)