tert-butyl 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: tert-butyl 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: tert-butyl 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetic acid tert-butyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NN=C(N1CCOC)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NN=C(N1CCOC)C2=CC=CC=C2

InChI

InChI=1S/C17H23N3O3S/c1-17(2,3)23-14(21)12-24-16-19-18-15(20(16)10-11-22-4)13-8-6-5-7-9-13/h5-9H,10-12H2,1-4H3