3-(2,4-dimethylphenoxy)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-(2,4-dimethylphenoxy)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(2,4-dimethylphenoxy)propanamide CAS Name: 3-(2,4-dimethylphenoxy)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(2,4-dimethylphenoxy)propanamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-(2,4-dimethylphenoxy)propionamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O2S2/c1-14-8-9-17(15(2)12-14)25-11-10-18(24)21-19-22-23-20(27-19)26-13-16-6-4-3-5-7-16/h3-9,12H,10-11,13H2,1-2H3,(H,21,22,24)