Vitas-M small molecule compound

(5Z)-1-(furan-2-ylmethyl)-5-({1-[2-(2-methoxyphenoxy)ethyl]-1H-indol-3-yl}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK086234
SMILES COc1ccccc1OCCn1cc(c2c1cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)Cc1ccco1

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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 C27H23N3O6 MW 485.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O6/c1-34-23-10-4-5-11-24(23)36-14-12-29-16-18(20-8-2-3-9-22(20)29)15-21-25(31)28-27(33)30(26(21)32)17-19-7-6-13-35-19/h2-11,13,15-16H,12,14,17H2,1H3,(H,28,31,33)/b21-15-
InChIKey
UFQGPQYKGOQUDV-QNGOZBTKSA-N
Synonyms
345337-67-9
(5Z)1(FURAN2YLMETHYL)5((1(2(2METHOXYPHENOXY)ETHYL)1HINDOL3YL)METHYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
(5Z)1(FURAN2YLMETHYL)5((1(2(2METHOXYPHENOXY)ETHYL)INDOL3YL)METHYLIDENE)13DIAZINANE246TRIONE
(Z)1(furan2ylmethyl)5((1(2(2methoxyphenoxy)ethyl)1Hindol3yl)methylene)pyrimidine246(1H3H5H)trione
345337679
COC1=CC=CC=C1OCCN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=O)N(C4=O)CC5=CC=CO5
COc1ccccc1OCCn1cc(c2c1cccc2)C=C1C(=O)NC(=O)N(C1=O)Cc1ccco1
InChI=1SC27H23N3O6c1342310451124(23)361412291618(20823922(20)29)152125(31)2827(33)30(26(21)32)171976133519h211131516H121417H21H3(H283133)b2115
MFCD02196083
STK086234
ZINC000002229551
ZINC02229551
ZINC13550909
ZINC2229551

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.