2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanoic acid

Systemtic Name: 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanoic acid Openeye Name: 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanoic acid CAS Name: 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]propanoic acid IUPAC Name: 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]propanoic acid Traditional Name: 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]propionic acid Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NN=C(N1CCOC)C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)O)SC1=NN=C(N1CCOC)C2=CC=CC=C2

InChI

InChI=1S/C14H17N3O3S/c1-10(13(18)19)21-14-16-15-12(17(14)8-9-20-2)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,18,19)