6-[[4-(4-pyridin-4-ylpiperazin-1-yl)sulfonylphenyl]methyl]-4-(trifluoromethyl)chromen-2-one

Systemtic Name: 6-[[4-(4-pyridin-4-ylpiperazin-1-yl)sulfonylphenyl]methyl]-4-(trifluoromethyl)chromen-2-one Openeye Name: 6-[[4-[4-(4-pyridyl)piperazin-1-yl]sulfonylphenyl]methyl]-4-(trifluoromethyl)chromen-2-one CAS Name: 6-[[4-[(4-pyridin-4-yl-1-piperazinyl)sulfonyl]phenyl]methyl]-4-(trifluoromethyl)-1-benzopyran-2-one IUPAC Name: 6-[[4-(4-pyridin-4-ylpiperazin-1-yl)sulfonylphenyl]methyl]-4-(trifluoromethyl)chromen-2-one Traditional Name: 6-[4-[4-(4-pyridyl)piperazino]sulfonylbenzyl]-4-(trifluoromethyl)coumarin Formula: C26H22F3N3O4S MolecularWeight: 529.53079

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)CC4=CC5=C(C=C4)OC(=O)C=C5C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)CC4=CC5=C(C=C4)OC(=O)C=C5C(F)(F)F

InChI

InChI=1S/C26H22F3N3O4S/c27-26(28,29)23-17-25(33)36-24-6-3-19(16-22(23)24)15-18-1-4-21(5-2-18)37(34,35)32-13-11-31(12-14-32)20-7-9-30-10-8-20/h1-10,16-17H,11-15H2