N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2,4,6-trimethylphenoxy)ethanamide

Systemtic Name: N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2,4,6-trimethylphenoxy)ethanamide Openeye Name: N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2,4,6-trimethylphenoxy)acetamide CAS Name: N-[5-[(4-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-(2,4,6-trimethylphenoxy)acetamide IUPAC Name: N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2,4,6-trimethylphenoxy)acetamide Traditional Name: N-[5-[(4-chlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-2-(2,4,6-trimethylphenoxy)acetamide Formula: C20H20ClN3O2S2 MolecularWeight: 433.9747

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCC(=O)NC2=NN=C(S2)SCC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C20H20ClN3O2S2/c1-12-8-13(2)18(14(3)9-12)26-10-17(25)22-19-23-24-20(28-19)27-11-15-4-6-16(21)7-5-15/h4-9H,10-11H2,1-3H3,(H,22,23,25)