1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(5-methyl-2-propan-2-yl-phenoxy)ethanone

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(5-methyl-2-propan-2-yl-phenoxy)ethanone Openeye Name: 2-(2-isopropyl-5-methyl-phenoxy)-1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-(5-methyl-2-propan-2-ylphenoxy)ethanone IUPAC Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-(5-methyl-2-propan-2-ylphenoxy)ethanone Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)-1-(4-tosylpiperazino)ethanone Formula: C23H30N2O4S MolecularWeight: 430.5603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=C(C=CC(=C3)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=C(C=CC(=C3)C)C(C)C

InChI

InChI=1S/C23H30N2O4S/c1-17(2)21-10-7-19(4)15-22(21)29-16-23(26)24-11-13-25(14-12-24)30(27,28)20-8-5-18(3)6-9-20/h5-10,15,17H,11-14,16H2,1-4H3