Vitas-M small molecule compound

(5Z)-5-(1H-benzimidazol-2-ylmethylidene)-3-(4-ethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione

Catalog ID
STK563405
SMILES CCc1ccc(cc1)N1C(=O)N=C(/C(=C/c2nc3c([nH]2)cccc3)/C1=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 C20H16N4O3 MW 360.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O3/c1-2-12-7-9-13(10-8-12)24-19(26)14(18(25)23-20(24)27)11-17-21-15-5-3-4-6-16(15)22-17/h3-11H,2H2,1H3,(H,21,22)(H,23,25,27)/b14-11-
InChIKey
QNYFUAWNXPOSSU-KAMYIIQDSA-N
Synonyms

(5Z)5(1HBENZIMIDAZOL2YLMETHYLIDENE)1(4ETHYLPHENYL)13DIAZINANE246TRIONE
(5Z)5(1Hbenzimidazol2ylmethylidene)3(4ethylphenyl)6hydroxypyrimidine24(3H5H)dione
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=NC4=CC=CC=C4N3)C(=O)NC2=O
CCc1ccc(cc1)N1C(=O)N=C(C(=Cc2nc3c((nH)2)cccc3)C1=O)O
InChI=1SC20H16N4O3c12127913(10812)2419(26)14(18(25)2320(24)27)11172115534616(15)2217h311H2H21H3(H2122)(H232527)b1411
MFCD03794308
PYRIMIDINE246TRIONE5(1HBENZOIMIDAZOL2YLMETHYLENE)1(4ETHYLPHENYL)
ZINC000006785475
ZINC06785475
ZINC6785475

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Available files

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