Vitas-M small molecule compound

N-[(1Z)-1-(4-methoxyphenyl)-3-{[2-(2-methyl-1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl]-3-nitrobenzamide

Catalog ID
STK768577
SMILES COc1ccc(cc1)/C=C(/C(=O)NCCc1c(C)[nH]c2c1cccc2)\NC(=O)c1cccc(c1)[N+](=O)[O-]

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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(16-19-10-12-22(37-2)13-11-19)31-27(33)20-6-5-7-21(17-20)32(35)36/h3-13,16-17,30H,14-15H2,1-2H3,(H,29,34)(H,31,33)/b26-16-
InChIKey
KTRSHKSXKBOTSG-QQXSKIMKSA-N
Synonyms

CC1=C(C2=CC=CC=C2N1)CCNC(=O)C(=CC3=CC=C(C=C3)OC)NC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
COc1ccc(cc1)C=C(C(=O)NCCc1c(C)(nH)c2c1cccc2)NC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC28H26N4O5c11823(24834925(24)3018)14152928(34)26(1619101222(372)131119)3127(33)2065721(1720)32(35)36h313161730H1415H212H3(H2934)(H3133)b2616
MFCD03308524
N((1Z)1(4methoxyphenyl)3((2(2methyl1Hindol3yl)ethyl)amino)3oxoprop1en2yl)3nitrobenzamide
N((Z)1(4METHOXYPHENYL)3(2(2METHYL1HINDOL3YL)ETHYLAMINO)3OXOPROP1EN2YL)3NITROBENZAMIDE
ZINC000003619519
ZINC03619519
ZINC3619519

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Available files

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