2-[[4-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-1,3-oxazol-5-yl]sulfanyl]-1-phenyl-ethanone

Systemtic Name: 2-[[4-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-1,3-oxazol-5-yl]sulfanyl]-1-phenyl-ethanone Openeye Name: 1-phenyl-2-[4-(p-tolylsulfonyl)-2-(2-thienyl)oxazol-5-yl]sulfanyl-ethanone CAS Name: 2-[[4-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-5-oxazolyl]thio]-1-phenylethanone IUPAC Name: 2-[[4-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-1,3-oxazol-5-yl]sulfanyl]-1-phenylethanone Traditional Name: 1-phenyl-2-[[2-(2-thienyl)-4-tosyl-oxazol-5-yl]thio]ethanone Formula: C22H17NO4S3 MolecularWeight: 455.56968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=CS3)SCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C3=CC=CS3)SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H17NO4S3/c1-15-9-11-17(12-10-15)30(25,26)21-22(27-20(23-21)19-8-5-13-28-19)29-14-18(24)16-6-3-2-4-7-16/h2-13H,14H2,1H3