4-[(8-chloranyl-7-fluoranyl-3,4-dihydro-2H-chromen-3-yl)sulfonyl]-1-[(4-oxidanyl-1-pyridin-4-yl-piperidin-4-yl)methyl]piperazin-2-one

Systemtic Name: 4-[(8-chloranyl-7-fluoranyl-3,4-dihydro-2H-chromen-3-yl)sulfonyl]-1-[(4-oxidanyl-1-pyridin-4-yl-piperidin-4-yl)methyl]piperazin-2-one Openeye Name: 4-(8-chloro-7-fluoro-chroman-3-yl)sulfonyl-1-[[4-hydroxy-1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one CAS Name: 4-[(8-chloro-7-fluoro-3,4-dihydro-2H-1-benzopyran-3-yl)sulfonyl]-1-[(4-hydroxy-1-pyridin-4-yl-4-piperidinyl)methyl]-2-piperazinone IUPAC Name: 4-[(8-chloro-7-fluoro-3,4-dihydro-2H-chromen-3-yl)sulfonyl]-1-[(4-hydroxy-1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-2-one Traditional Name: 4-(8-chloro-7-fluoro-chroman-3-yl)sulfonyl-1-[[4-hydroxy-1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one Formula: C24H28ClFN4O5S MolecularWeight: 539.019323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CN2CCN(CC2=O)S(=O)(=O)C3CC4=C(C(=C(C=C4)F)Cl)OC3)O)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1(CN2CCN(CC2=O)S(=O)(=O)C3CC4=C(C(=C(C=C4)F)Cl)OC3)O)C5=CC=NC=C5

InChI

InChI=1S/C24H28ClFN4O5S/c25-22-20(26)2-1-17-13-19(15-35-23(17)22)36(33,34)30-12-11-29(21(31)14-30)16-24(32)5-9-28(10-6-24)18-3-7-27-8-4-18/h1-4,7-8,19,32H,5-6,9-16H2