1-[5-(3-methoxyprop-1-ynyl)-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone

Systemtic Name: 1-[5-(3-methoxyprop-1-ynyl)-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone Openeye Name: 1-[5-(3-methoxyprop-1-ynyl)-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone CAS Name: 1-[5-(3-methoxyprop-1-ynyl)-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone IUPAC Name: 1-[5-(3-methoxyprop-1-ynyl)-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone Traditional Name: 1-[5-(3-methoxyprop-1-ynyl)-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(SC(=N1)C#CCOC)(C)C2=CC=CC=C2

Isomeric SMILES

CC(=O)N1C(SC(=N1)C#CCOC)(C)C2=CC=CC=C2

InChI

InChI=1S/C15H16N2O2S/c1-12(18)17-15(2,13-8-5-4-6-9-13)20-14(16-17)10-7-11-19-3/h4-6,8-9H,11H2,1-3H3