N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(2-phenylethynyl)benzamide

Systemtic Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(2-phenylethynyl)benzamide Openeye Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(2-phenylethynyl)benzamide CAS Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(2-phenylethynyl)benzamide IUPAC Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(2-phenylethynyl)benzamide Traditional Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(2-phenylethynyl)benzamide Formula: C18H13N3OS MolecularWeight: 319.38032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C18H13N3OS/c1-13-20-21-18(23-13)19-17(22)16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-12H,1H3,(H,19,21,22)