3-(4-methylphenyl)sulfanyl-N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide

Systemtic Name: 3-(4-methylphenyl)sulfanyl-N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide Openeye Name: N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-3-(p-tolylsulfanyl)propanamide CAS Name: 3-[(4-methylphenyl)thio]-N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide IUPAC Name: 3-(4-methylphenyl)sulfanyl-N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]propanamide Traditional Name: N-[5-(4-mesylbenzyl)-1,3,4-oxadiazol-2-yl]-3-(p-tolylthio)propionamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC2=NN=C(O2)CC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC2=NN=C(O2)CC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C20H21N3O4S2/c1-14-3-7-16(8-4-14)28-12-11-18(24)21-20-23-22-19(27-20)13-15-5-9-17(10-6-15)29(2,25)26/h3-10H,11-13H2,1-2H3,(H,21,23,24)