2-(4-tert-butylphenoxy)-N-[5-[(3-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[5-[(3-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[5-(m-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[5-[(3-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[5-[(3-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[5-[(3-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]acetamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(S2)NC(=O)COC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(S2)NC(=O)COC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H25N3O2S2/c1-15-6-5-7-16(12-15)14-28-21-25-24-20(29-21)23-19(26)13-27-18-10-8-17(9-11-18)22(2,3)4/h5-12H,13-14H2,1-4H3,(H,23,24,26)