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

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 2-(4-tert-butylphenoxy)-N-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]propionamide Formula: C23H27N3O2S2 MolecularWeight: 441.60938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C(C)OC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C(C)OC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H27N3O2S2/c1-15-6-8-17(9-7-15)14-29-22-26-25-21(30-22)24-20(27)16(2)28-19-12-10-18(11-13-19)23(3,4)5/h6-13,16H,14H2,1-5H3,(H,24,25,27)