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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)(CCO)S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)Cl)C4=NC=C(C=N4)C5=CC=NC=C5

Isomeric SMILES

C1CN(C(CN1)(CCO)S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)Cl)C4=NC=C(C=N4)C5=CC=NC=C5

InChI

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