1-[3-(2-methoxyethoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[3-(2-methoxyethoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[3-(2-methoxyethoxy)-5-(2-thienyl)-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 1-[3-(2-methoxyethoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[3-(2-methoxyethoxy)-5-thiophen-2-yl-1,2,4-triazol-1-yl]-2,2-dimethylpropan-1-one Traditional Name: 1-[3-(2-methoxyethoxy)-5-(2-thienyl)-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1C(=NC(=N1)OCCOC)C2=CC=CS2

Isomeric SMILES

CC(C)(C)C(=O)N1C(=NC(=N1)OCCOC)C2=CC=CS2

InChI

InChI=1S/C14H19N3O3S/c1-14(2,3)12(18)17-11(10-6-5-9-21-10)15-13(16-17)20-8-7-19-4/h5-6,9H,7-8H2,1-4H3