Vitas-M small molecule compound
2-cyano-N'-[(E)-(4-methoxy-3-{[(1S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}phenyl)methylidene]acetohydrazide
Catalog ID
STL541487
SMILES N#CCC(=O)N/N=C/c1ccc(c(c1)CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)OC
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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 C23H25N5O3 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O3/c1-31-21-6-5-16(11-25-26-22(29)7-8-24)9-19(21)15-27-12-17-10-18(14-27)20-3-2-4-23(30)28(20)13-17/h2-6,9,11,17-18H,7,10,12-15H2,1H3,(H,26,29)/b25-11+/t17-,18-/m0/s1InChIKey
UEDDVLRDGRLRAV-FFTFBOGBSA-NSynonyms
(E)2cyanoN(4methoxy3(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)benzylidene)acetohydrazideacetate
2cyanoN((E)(4methoxy3(((1S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)phenyl)methylidene)acetohydrazide
CC(=O)ON#CCC(=O)NN=Cc1ccc(c(c1)CN1C(C@H)2CC(C1)c1n(C2)c(=O)ccc1)OC
InChI=1SC23H25N5O3c131216516(11252622(29)7824)919(21)152712171018(1427)2032423(30)28(20)1317h269111718H7101215H21H3(H2629)b2511+t1718m0s1
MFCD06763848
ZINC000104711683
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