1-(5-hex-1-ynyl-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl)ethanone

Systemtic Name: 1-(5-hex-1-ynyl-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl)ethanone Openeye Name: 1-(5-hex-1-ynyl-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl)ethanone CAS Name: 1-(5-hex-1-ynyl-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl)ethanone IUPAC Name: 1-(5-hex-1-ynyl-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl)ethanone Traditional Name: 1-(5-hex-1-ynyl-2-methyl-2-phenyl-1,3,4-thiadiazol-3-yl)ethanone Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=NN(C(S1)(C)C2=CC=CC=C2)C(=O)C

Isomeric SMILES

CCCCC#CC1=NN(C(S1)(C)C2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C17H20N2OS/c1-4-5-6-10-13-16-18-19(14(2)20)17(3,21-16)15-11-8-7-9-12-15/h7-9,11-12H,4-6H2,1-3H3