Vitas-M small molecule compound
5-bromo-N-{5-(ethylcarbamoyl)-2-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]phenyl}pyridine-3-carboxamide
Catalog ID
STL539834
SMILES CCNC(=O)c1ccc(c(c1)NC(=O)c1cncc(c1)Br)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H26BrN5O3 MW 536.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26BrN5O3/c1-2-29-25(34)17-6-7-23(21(10-17)30-26(35)18-9-20(27)12-28-11-18)31-13-16-8-19(15-31)22-4-3-5-24(33)32(22)14-16/h3-7,9-12,16,19H,2,8,13-15H2,1H3,(H,29,34)(H,30,35)/t16-,19+/m0/s1InChIKey
UQBFHHRIYVQTJW-QFBILLFUSA-NSynonyms
5bromoN(5(ethylcarbamoyl)2((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)phenyl)nicotinamide
5bromoN(5(ethylcarbamoyl)2((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)phenyl)pyridine3carboxamide
CCNC(=O)c1ccc(c(c1)NC(=O)c1cncc(c1)Br)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC26H26BrN5O3c122925(34)176723(21(1017)3026(35)18920(27)12281118)311316819(1531)2243524(33)32(22)1416h379121619H281315H21H3(H2934)(H3035)t1619+m0s1
ZINC000097971871
Check stock
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Check stock on Vitas-MAvailable files
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