Vitas-M small molecule compound
N-{(1E)-3-{[3-(1H-imidazol-1-yl)propyl]amino}-1-[5-(3-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide
Catalog ID
STK821492
SMILES COc1ccc(cc1)C(=O)N/C(=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/C(=O)NCCCn1cncc1
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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 C27H25N5O6 MW 515.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O6/c1-37-22-8-6-19(7-9-22)26(33)30-24(27(34)29-12-3-14-31-15-13-28-18-31)17-23-10-11-25(38-23)20-4-2-5-21(16-20)32(35)36/h2,4-11,13,15-18H,3,12,14H2,1H3,(H,29,34)(H,30,33)/b24-17+InChIKey
XRTQJWNBLILLKT-JJIBRWJFSA-NSynonyms
(2E)N(3(1HIMIDAZOL1YL)PROPYL)2((4METHOXYPHENYL)FORMAMIDO)3(5(3NITROPHENYL)FURAN2YL)PROP2ENAMIDE
COC1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)NCCCN4C=CN=C4
COc1ccc(cc1)C(=O)NC(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))C(=O)NCCCn1cncc1
InChI=1SC27H25N5O6c137228619(7922)26(33)3024(27(34)2912314311513281831)1723101125(3823)2042521(1620)32(35)36h2411131518H31214H21H3(H2934)(H3033)b2417+
MFCD03088774
N((1E)3((3(1Himidazol1yl)propyl)amino)1(5(3nitrophenyl)furan2yl)3oxoprop1en2yl)4methoxybenzamide
N((E)3(3IMIDAZOL1YLPROPYLAMINO)1(5(3NITROPHENYL)FURAN2YL)3OXOPROP1EN2YL)4METHOXYBENZAMIDE
ZINC000005357816
ZINC05357816
ZINC5357816
Check stock
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Check stock on Vitas-MAvailable files
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