Vitas-M small molecule compound
(5E)-5-(1-{[2-(cyclohex-1-en-1-yl)ethyl]amino}ethylidene)-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK573235
SMILES O=C1N=C(O)/C(=C(\NCCC2=CCCCC2)/C)/C(=O)N1c1ccccc1C
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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/c1-14-8-6-7-11-17(14)24-20(26)18(19(25)23-21(24)27)15(2)22-13-12-16-9-4-3-5-10-16/h6-9,11,22H,3-5,10,12-13H2,1-2H3,(H,23,25,27)/b18-15+InChIKey
DGUBSBAXNPTHAS-OBGWFSINSA-NSynonyms
(5E)5(1((2(cyclohex1en1yl)ethyl)amino)ethylidene)6hydroxy3(2methylphenyl)pyrimidine24(3H5H)dione
(5E)5(1(2(CYCLOHEXEN1YL)ETHYLAMINO)ETHYLIDENE)1(2METHYLPHENYL)13DIAZINANE246TRIONE
CC1=CC=CC=C1N2C(=O)C(=C(C)NCCC3=CCCCC3)C(=O)NC2=O
InChI=1SC21H25N3O3c1148671117(14)2420(26)18(19(25)2321(24)27)15(2)2213121694351016h691122H35101213H212H3(H232527)b1815+
MFCD07199197
O=C1N=C(O)C(=C(NCCC2=CCCCC2)C)C(=O)N1c1ccccc1C
ZINC000059580580
ZINC20357462
ZINC59580580
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