2-[5-[3-(2-dimethylaminoethyl)-1-benzofuran-5-yl]pyridin-3-yl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[5-[3-(2-dimethylaminoethyl)-1-benzofuran-5-yl]pyridin-3-yl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[5-[3-(2-dimethylaminoethyl)benzofuran-5-yl]-3-pyridyl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-[5-[3-(2-dimethylaminoethyl)-5-benzofuranyl]-3-pyridinyl]-1-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-[5-[3-(2-dimethylaminoethyl)-1-benzofuran-5-yl]pyridin-3-yl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[5-[3-(2-dimethylaminoethyl)benzofuran-5-yl]-3-pyridyl]-1-(4-mesylpiperazino)ethanone Formula: C24H30N4O4S MolecularWeight: 470.5844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=COC2=C1C=C(C=C2)C3=CC(=CN=C3)CC(=O)N4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CN(C)CCC1=COC2=C1C=C(C=C2)C3=CC(=CN=C3)CC(=O)N4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C24H30N4O4S/c1-26(2)7-6-20-17-32-23-5-4-19(14-22(20)23)21-12-18(15-25-16-21)13-24(29)27-8-10-28(11-9-27)33(3,30)31/h4-5,12,14-17H,6-11,13H2,1-3H3