Vitas-M small molecule compound
(5E)-3-benzyl-5-(1-{[2-(cyclohex-1-en-1-yl)ethyl]amino}ethylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Catalog ID
STK568691
SMILES O=C1N=C(O)/C(=C(\NCCC2=CCCCC2)/C)/C(=O)N1Cc1ccccc1
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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 C21H25N3O3 MW 367.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O3/c1-15(22-13-12-16-8-4-2-5-9-16)18-19(25)23-21(27)24(20(18)26)14-17-10-6-3-7-11-17/h3,6-8,10-11,22H,2,4-5,9,12-14H2,1H3,(H,23,25,27)/b18-15+InChIKey
JERKHWKIZADNRA-OBGWFSINSA-NSynonyms
(5E)1BENZYL5(1(2(CYCLOHEXEN1YL)ETHYLAMINO)ETHYLIDENE)13DIAZINANE246TRIONE
(5E)3benzyl5(1((2(cyclohex1en1yl)ethyl)amino)ethylidene)6hydroxypyrimidine24(3H5H)dione
CC(=C1C(=O)NC(=O)N(C1=O)CC2=CC=CC=C2)NCCC3=CCCCC3
InChI=1SC21H25N3O3c115(221312168425916)1819(25)2321(27)24(20(18)26)1417106371117h368101122H24591214H21H3(H232527)b1815+
MFCD05731836
O=C1N=C(O)C(=C(NCCC2=CCCCC2)C)C(=O)N1Cc1ccccc1
ZINC000101037324
ZINC101037324
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