Vitas-M small molecule compound

(5Z)-1-(4-ethylphenyl)-5-{[1-(4-ethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK712447
SMILES CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)CC)C)/C1=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 C27H27N3O3 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O3/c1-5-19-7-11-22(12-8-19)29-17(3)15-21(18(29)4)16-24-25(31)28-27(33)30(26(24)32)23-13-9-20(6-2)10-14-23/h7-16H,5-6H2,1-4H3,(H,28,31,33)/b24-16-
InChIKey
DEGLKARPKGWVOF-JLPGSUDCSA-N
Synonyms
799817-71-3
(5Z)1(4ethylphenyl)5((1(4ethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)pyrimidine246(1H3H5H)trione
(5Z)1(4ETHYLPHENYL)5((1(4ETHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)13DIAZINANE246TRIONE
(Z)1(4ethylphenyl)5((1(4ethylphenyl)25dimethyl1Hpyrrol3yl)methylene)pyrimidine246(1H3H5H)trione
799817713
CCC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)CC)C
CCc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cc(n(c2C)c2ccc(cc2)CC)C)C1=O
InChI=1SC27H27N3O3c151971122(12819)2917(3)1521(18(29)4)162425(31)2827(33)30(26(24)32)2313920(62)101423h716H56H214H3(H283133)b2416
MFCD03681338
ZINC000013688678
ZINC13688678

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Available files

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