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

Systemtic Name: N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2-propan-2-ylphenoxy)ethanamide Openeye Name: 2-(2-isopropylphenoxy)-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-(2-propan-2-ylphenoxy)acetamide IUPAC Name: N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-(2-propan-2-ylphenoxy)acetamide Traditional Name: 2-(2-isopropylphenoxy)-N-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]acetamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)COC3=CC=CC=C3C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)COC3=CC=CC=C3C(C)C

InChI

InChI=1S/C21H23N3O2S2/c1-14(2)17-6-4-5-7-18(17)26-12-19(25)22-20-23-24-21(28-20)27-13-16-10-8-15(3)9-11-16/h4-11,14H,12-13H2,1-3H3,(H,22,23,25)