Vitas-M small molecule compound
4-methoxy-N-[(1Z)-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Catalog ID
STK768460
SMILES COc1ccc(cc1)C(=O)N/C(=C\c1cccc(c1)[N+](=O)[O-])/C(=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 C28H26N4O5 MW 498.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O5/c1-18-23(24-8-3-4-9-25(24)30-18)14-15-29-28(34)26(17-19-6-5-7-21(16-19)32(35)36)31-27(33)20-10-12-22(37-2)13-11-20/h3-13,16-17,30H,14-15H2,1-2H3,(H,29,34)(H,31,33)/b26-17-InChIKey
QKJLKMGHTXTEQI-ONUIUJJFSA-NSynonyms
4methoxyN((1Z)3((2(2methyl1Hindol3yl)ethyl)amino)1(3nitrophenyl)3oxoprop1en2yl)benzamide
4METHOXYN((Z)3(2(2METHYL1HINDOL3YL)ETHYLAMINO)1(3NITROPHENYL)3OXOPROP1EN2YL)BENZAMIDE
CC1=C(C2=CC=CC=C2N1)CCNC(=O)C(=CC3=CC(=CC=C3)(N+)(=O)(O))NC(=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)C(=O)NC(=Cc1cccc(c1)(N+)(=O)(O))C(=O)NCCc1c(C)(nH)c2c1cccc2
InChI=1SC28H26N4O5c11823(24834925(24)3018)14152928(34)26(171965721(1619)32(35)36)3127(33)20101222(372)131120h313161730H1415H212H3(H2934)(H3133)b2617
MFCD03133482
ZINC000003619282
ZINC03619282
ZINC3619282
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