N-[2,2-dimethyl-3-oxidanyl-6-(4-pyridin-4-ylpiperazin-1-yl)carbonyl-3,4-dihydrochromen-4-yl]-4-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[2,2-dimethyl-3-oxidanyl-6-(4-pyridin-4-ylpiperazin-1-yl)carbonyl-3,4-dihydrochromen-4-yl]-4-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[3-hydroxy-2,2-dimethyl-6-[4-(4-pyridyl)piperazine-1-carbonyl]chroman-4-yl]-4-(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-hydroxy-2,2-dimethyl-6-[oxo-(4-pyridin-4-yl-1-piperazinyl)methyl]-3,4-dihydro-2H-1-benzopyran-4-yl]-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[3-hydroxy-2,2-dimethyl-6-(4-pyridin-4-ylpiperazine-1-carbonyl)-3,4-dihydrochromen-4-yl]-4-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[3-hydroxy-2,2-dimethyl-6-[4-(4-pyridyl)piperazine-1-carbonyl]chroman-4-yl]-4-(trifluoromethyl)benzenesulfonamide Formula: C28H29F3N4O5S MolecularWeight: 590.61387

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C(=O)N3CCN(CC3)C4=CC=NC=C4)NS(=O)(=O)C5=CC=C(C=C5)C(F)(F)F)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C(=O)N3CCN(CC3)C4=CC=NC=C4)NS(=O)(=O)C5=CC=C(C=C5)C(F)(F)F)O)C

InChI

InChI=1S/C28H29F3N4O5S/c1-27(2)25(36)24(33-41(38,39)21-6-4-19(5-7-21)28(29,30)31)22-17-18(3-8-23(22)40-27)26(37)35-15-13-34(14-16-35)20-9-11-32-12-10-20/h3-12,17,24-25,33,36H,13-16H2,1-2H3