N-[5-[(2-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-ethyl-benzamide

Systemtic Name: N-[5-[(2-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-ethyl-benzamide Openeye Name: N-[5-[(2-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-ethyl-benzamide CAS Name: N-[5-[(2-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-ethylbenzamide IUPAC Name: N-[5-[(2-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-ethylbenzamide Traditional Name: N-[5-[(2-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]-4-ethyl-benzamide Formula: C19H16N4OS2 MolecularWeight: 380.48654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3C#N

InChI

InChI=1S/C19H16N4OS2/c1-2-13-7-9-14(10-8-13)17(24)21-18-22-23-19(26-18)25-12-16-6-4-3-5-15(16)11-20/h3-10H,2,12H2,1H3,(H,21,22,24)