2-[4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-1-(5-pyridin-2-ylpyrimidin-2-yl)piperazin-2-yl]ethanol

Systemtic Name: 2-[4-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]-1-(5-pyridin-2-ylpyrimidin-2-yl)piperazin-2-yl]ethanol Openeye Name: 2-[4-(6-chlorobenzothiophen-2-yl)sulfonyl-1-[5-(2-pyridyl)pyrimidin-2-yl]piperazin-2-yl]ethanol CAS Name: 2-[4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-1-[5-(2-pyridinyl)-2-pyrimidinyl]-2-piperazinyl]ethanol IUPAC Name: 2-[4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-1-(5-pyridin-2-ylpyrimidin-2-yl)piperazin-2-yl]ethanol Traditional Name: 2-[4-(6-chlorobenzothiophen-2-yl)sulfonyl-1-[5-(2-pyridyl)pyrimidin-2-yl]piperazin-2-yl]ethanol Formula: C23H22ClN5O3S2 MolecularWeight: 516.03548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)Cl)CCO)C4=NC=C(C=N4)C5=CC=CC=N5

Isomeric SMILES

C1CN(C(CN1S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)Cl)CCO)C4=NC=C(C=N4)C5=CC=CC=N5

InChI

InChI=1S/C23H22ClN5O3S2/c24-18-5-4-16-11-22(33-21(16)12-18)34(31,32)28-8-9-29(19(15-28)6-10-30)23-26-13-17(14-27-23)20-3-1-2-7-25-20/h1-5,7,11-14,19,30H,6,8-10,15H2