2-(4-fluoranylphenoxy)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]ethanamide

Systemtic Name: 2-(4-fluoranylphenoxy)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]ethanamide Openeye Name: 2-(4-fluorophenoxy)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]acetamide CAS Name: 2-(4-fluorophenoxy)-N-[2-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]ethyl]acetamide IUPAC Name: 2-(4-fluorophenoxy)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylethyl]acetamide Traditional Name: 2-(4-fluorophenoxy)-N-[2-[4-(2-pyrimidyl)piperazino]sulfonylethyl]acetamide Formula: C18H22FN5O4S MolecularWeight: 423.461783

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCNC(=O)COC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCNC(=O)COC3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN5O4S/c19-15-2-4-16(5-3-15)28-14-17(25)20-8-13-29(26,27)24-11-9-23(10-12-24)18-21-6-1-7-22-18/h1-7H,8-14H2,(H,20,25)