N-(5-bromanylpyridin-2-yl)-1-ethanoyl-6-[[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]carbonylamino]-3,4-dihydro-2H-pyridine-5-carboxamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-1-ethanoyl-6-[[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]carbonylamino]-3,4-dihydro-2H-pyridine-5-carboxamide Openeye Name: 1-acetyl-N-(5-bromo-2-pyridyl)-6-[[2-fluoro-4-(2-methylsulfonylphenyl)benzoyl]amino]-3,4-dihydro-2H-pyridine-5-carboxamide CAS Name: 1-acetyl-N-(5-bromo-2-pyridinyl)-6-[[[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-oxomethyl]amino]-3,4-dihydro-2H-pyridine-5-carboxamide IUPAC Name: 1-acetyl-N-(5-bromopyridin-2-yl)-6-[[2-fluoro-4-(2-methylsulfonylphenyl)benzoyl]amino]-3,4-dihydro-2H-pyridine-5-carboxamide Traditional Name: 1-acetyl-N-(5-bromo-2-pyridyl)-6-[[2-fluoro-4-(2-mesylphenyl)benzoyl]amino]-3,4-dihydro-2H-pyridine-5-carboxamide Formula: C27H24BrFN4O5S MolecularWeight: 615.470663

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC(=C1NC(=O)C2=C(C=C(C=C2)C3=CC=CC=C3S(=O)(=O)C)F)C(=O)NC4=NC=C(C=C4)Br

Isomeric SMILES

CC(=O)N1CCCC(=C1NC(=O)C2=C(C=C(C=C2)C3=CC=CC=C3S(=O)(=O)C)F)C(=O)NC4=NC=C(C=C4)Br

InChI

InChI=1S/C27H24BrFN4O5S/c1-16(34)33-13-5-7-21(27(36)31-24-12-10-18(28)15-30-24)25(33)32-26(35)20-11-9-17(14-22(20)29)19-6-3-4-8-23(19)39(2,37)38/h3-4,6,8-12,14-15H,5,7,13H2,1-2H3,(H,32,35)(H,30,31,36)