(6-methoxypyridin-3-yl)-[4-[4-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (6-methoxypyridin-3-yl)-[4-[4-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (6-methoxy-3-pyridyl)-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: (6-methoxy-3-pyridinyl)-[4-[4-(trifluoromethoxy)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (6-methoxypyridin-3-yl)-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (6-methoxy-3-pyridyl)-[4-[4-(trifluoromethoxy)phenyl]sulfonylpiperazino]methanone Formula: C18H18F3N3O5S MolecularWeight: 445.41283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

COC1=NC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C18H18F3N3O5S/c1-28-16-7-2-13(12-22-16)17(25)23-8-10-24(11-9-23)30(26,27)15-5-3-14(4-6-15)29-18(19,20)21/h2-7,12H,8-11H2,1H3