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

Systemtic Name: 1-[5-[3-(dimethylamino)prop-1-ynyl]-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone Openeye Name: 1-[5-[3-(dimethylamino)prop-1-ynyl]-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone CAS Name: 1-[5-[3-(dimethylamino)prop-1-ynyl]-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone IUPAC Name: 1-[5-[3-(dimethylamino)prop-1-ynyl]-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone Traditional Name: 1-[5-[3-(dimethylamino)prop-1-ynyl]-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl]ethanone Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3OS/c1-13(20)19-16(2,14-9-6-5-7-10-14)21-15(17-19)11-8-12-18(3)4/h5-7,9-10H,12H2,1-4H3