2-[[4-(3-morpholin-4-ylpropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-(3-morpholin-4-ylpropyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-(3-morpholinopropyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-[3-(4-morpholinyl)propyl]-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-(3-morpholin-4-ylpropyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-(3-morpholinopropyl)-1,2,4-triazol-3-yl]thio]acetic acid Formula: C11H18N4O3S MolecularWeight: 286.35062

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN2C=NN=C2SCC(=O)O

Isomeric SMILES

C1COCCN1CCCN2C=NN=C2SCC(=O)O

InChI

InChI=1S/C11H18N4O3S/c16-10(17)8-19-11-13-12-9-15(11)3-1-2-14-4-6-18-7-5-14/h9H,1-8H2,(H,16,17)