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

Systemtic Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2,4-dimethoxyphenyl)ethanamide Openeye Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2,4-dimethoxyphenyl)acetamide CAS Name: N-[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-(2,4-dimethoxyphenyl)acetamide IUPAC Name: N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2,4-dimethoxyphenyl)acetamide Traditional Name: N-[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]-2-(2,4-dimethoxyphenyl)acetamide Formula: C20H18N4O3S2 MolecularWeight: 426.51192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CC(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)C#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CC(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)C#N)OC

InChI

InChI=1S/C20H18N4O3S2/c1-26-16-8-7-15(17(10-16)27-2)9-18(25)22-19-23-24-20(29-19)28-12-14-5-3-13(11-21)4-6-14/h3-8,10H,9,12H2,1-2H3,(H,22,23,25)