2-[[4-(2-chloranylphenoxy)phenyl]methylsulfinyl]-1-(4-ethanoylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[4-(2-chloranylphenoxy)phenyl]methylsulfinyl]-1-(4-ethanoylpiperazin-1-yl)ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[[4-(2-chlorophenoxy)phenyl]methylsulfinyl]ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[[4-(2-chlorophenoxy)phenyl]methylsulfinyl]ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-[[4-(2-chlorophenoxy)phenyl]methylsulfinyl]ethanone Traditional Name: 1-(4-acetylpiperazino)-2-[4-(2-chlorophenoxy)benzyl]sulfinyl-ethanone Formula: C21H23ClN2O4S MolecularWeight: 434.93632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CS(=O)CC2=CC=C(C=C2)OC3=CC=CC=C3Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CS(=O)CC2=CC=C(C=C2)OC3=CC=CC=C3Cl

InChI

InChI=1S/C21H23ClN2O4S/c1-16(25)23-10-12-24(13-11-23)21(26)15-29(27)14-17-6-8-18(9-7-17)28-20-5-3-2-4-19(20)22/h2-9H,10-15H2,1H3