Vitas-M small molecule compound

(5Z)-5-(1H-benzimidazol-2-ylmethylidene)-1-(2-phenylethyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK533654
SMILES O=C1NC(=O)/C(=C/c2nc3c([nH]2)cccc3)/C(=O)N1CCc1ccccc1

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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/c25-18-14(12-17-21-15-8-4-5-9-16(15)22-17)19(26)24(20(27)23-18)11-10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,22)(H,23,25,27)/b14-12-
InChIKey
HIXAWXYJYIDAFO-OWBHPGMISA-N
Synonyms

(5Z)5(1Hbenzimidazol2ylmethylidene)1(2phenylethyl)13diazinane246trione
(5Z)5(1Hbenzimidazol2ylmethylidene)1(2phenylethyl)pyrimidine246(1H3H5H)trione
(5Z)5(1HBENZIMIDAZOL2YLMETHYLIDENE)1PHENETHYL13DIAZINANE246TRIONE
(Z)5((1Hbenzo(d)imidazol2yl)methylene)1phenethylpyrimidine246(1H3H5H)trione
C1=CC=C(C=C1)CCN2C(=O)C(=CC3=NC4=CC=CC=C4N3)C(=O)NC2=O
InChI=1SC20H16N4O3c251814(12172115845916(15)2217)19(26)24(20(27)2318)1110136213713h1912H1011H2(H2122)(H232527)b1412
MFCD01945266
O=C1NC(=O)C(=Cc2nc3c((nH)2)cccc3)C(=O)N1CCc1ccccc1
ZINC000008995273
ZINC08995273
ZINC8995273

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Available files

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