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

Systemtic Name: N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-phenylmethoxy-ethanamide Openeye Name: 2-benzyloxy-N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[5-[(3,5-dimethylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-phenylmethoxyacetamide IUPAC Name: N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-phenylmethoxyacetamide Traditional Name: 2-benzoxy-N-[5-[(3,5-dimethylbenzyl)thio]-1,3,4-thiadiazol-2-yl]acetamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSC2=NN=C(S2)NC(=O)COCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSC2=NN=C(S2)NC(=O)COCC3=CC=CC=C3)C

InChI

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