Vitas-M small molecule compound
(5Z)-1-(2,3-dichlorophenyl)-5-[3-methyl-4-(pyrrolidin-1-yl)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK202238
SMILES O=C1NC(=O)N(C(=O)/C/1=C\c1ccc(c(c1)C)N1CCCC1)c1cccc(c1Cl)Cl
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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 C22H19Cl2N3O3 MW 444.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19Cl2N3O3/c1-13-11-14(7-8-17(13)26-9-2-3-10-26)12-15-20(28)25-22(30)27(21(15)29)18-6-4-5-16(23)19(18)24/h4-8,11-12H,2-3,9-10H2,1H3,(H,25,28,30)/b15-12-InChIKey
HIEOQBQDZHHMLD-QINSGFPZSA-NSynonyms
(5Z)1(23dichlorophenyl)5((3methyl4pyrrolidin1ylphenyl)methylidene)13diazinane246trione
(5Z)1(23DICHLOROPHENYL)5(3METHYL4(PYRROLIDIN1YL)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=C(C(=CC=C3)Cl)Cl)N4CCCC4
InChI=1SC22H19Cl2N3O3c1131114(7817(13)269231026)121520(28)2522(30)27(21(15)29)1864516(23)19(18)24h481112H23910H21H3(H252830)b1512
MFCD03237946
O=C1NC(=O)N(C(=O)C1=Cc1ccc(c(c1)C)N1CCCC1)c1cccc(c1Cl)Cl
ZINC000012393146
ZINC12393146
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