2-[[5-[(2,6-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[[5-[(2,6-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]-N-phenethyl-acetamide Formula: C20H22N4OS2 MolecularWeight: 398.54488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NN=C(S2)SCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NN=C(S2)SCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS2/c1-14-7-6-8-15(2)18(14)22-19-23-24-20(27-19)26-13-17(25)21-12-11-16-9-4-3-5-10-16/h3-10H,11-13H2,1-2H3,(H,21,25)(H,22,23)