1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2,5-dimethylphenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2,5-dimethylphenyl)sulfanyl-ethanone Openeye Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2,5-dimethylphenyl)sulfanyl-ethanone CAS Name: 1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-[(2,5-dimethylphenyl)thio]ethanone IUPAC Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(2,5-dimethylphenyl)sulfanylethanone Traditional Name: 1-[4-(2,3-dimethylphenyl)piperazino]-2-[(2,5-dimethylphenyl)thio]ethanone Formula: C22H28N2OS MolecularWeight: 368.53552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C22H28N2OS/c1-16-8-9-18(3)21(14-16)26-15-22(25)24-12-10-23(11-13-24)20-7-5-6-17(2)19(20)4/h5-9,14H,10-13,15H2,1-4H3