1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-(2,4,6-trimethylphenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-(2,4,6-trimethylphenyl)sulfanyl-ethanone Openeye Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-(2,4,6-trimethylphenyl)sulfanyl-ethanone CAS Name: 1-[4-(4-methoxyphenyl)-1-piperazinyl]-2-[(2,4,6-trimethylphenyl)thio]ethanone IUPAC Name: 1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-(2,4,6-trimethylphenyl)sulfanylethanone Traditional Name: 2-(mesitylthio)-1-[4-(4-methoxyphenyl)piperazino]ethanone Formula: C22H28N2O2S MolecularWeight: 384.53492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)SCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H28N2O2S/c1-16-13-17(2)22(18(3)14-16)27-15-21(25)24-11-9-23(10-12-24)19-5-7-20(26-4)8-6-19/h5-8,13-14H,9-12,15H2,1-4H3