Vitas-M small molecule compound
N-[(1Z)-1-(1,3-benzodioxol-5-yl)-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl]-3-nitrobenzamide
Catalog ID
STK773359
SMILES O=C(/C(=C/c1ccc2c(c1)OCO2)/NC(=O)c1cccc(c1)[N+](=O)[O-])NCCc1c(C)[nH]c2c1cccc2
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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 C28H24N4O6 MW 512.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O6/c1-17-21(22-7-2-3-8-23(22)30-17)11-12-29-28(34)24(13-18-9-10-25-26(14-18)38-16-37-25)31-27(33)19-5-4-6-20(15-19)32(35)36/h2-10,13-15,30H,11-12,16H2,1H3,(H,29,34)(H,31,33)/b24-13-InChIKey
DNWQQEPLGRYLOE-CFRMEGHHSA-NSynonyms
CC1=C(C2=CC=CC=C2N1)CCNC(=O)C(=CC3=CC4=C(C=C3)OCO4)NC(=O)C5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC28H24N4O6c11721(22723823(22)3017)11122928(34)24(13189102526(1418)38163725)3127(33)1954620(1519)32(35)36h210131530H111216H21H3(H2934)(H3133)b2413
MFCD03821702
N((1Z)1(13benzodioxol5yl)3((2(2methyl1Hindol3yl)ethyl)amino)3oxoprop1en2yl)3nitrobenzamide
N((Z)1(13BENZODIOXOL5YL)3(2(2METHYL1HINDOL3YL)ETHYLAMINO)3OXOPROP1EN2YL)3NITROBENZAMIDE
O=C(C(=Cc1ccc2c(c1)OCO2)NC(=O)c1cccc(c1)(N+)(=O)(O))NCCc1c(C)(nH)c2c1cccc2
ZINC000003627016
ZINC03627016
ZINC3627016
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