Vitas-M small molecule compound
(5E)-1-(3-bromophenyl)-5-[3-methoxy-5-(prop-2-en-1-yl)-4-(prop-2-yn-1-yloxy)benzylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170533
SMILES C#CCOc1c(CC=C)cc(cc1OC)/C=C/1\C(=O)NC(=O)N(C1=O)c1cccc(c1)Br
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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 C24H19BrN2O5 MW 495.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19BrN2O5/c1-4-7-16-11-15(13-20(31-3)21(16)32-10-5-2)12-19-22(28)26-24(30)27(23(19)29)18-9-6-8-17(25)14-18/h2,4,6,8-9,11-14H,1,7,10H2,3H3,(H,26,28,30)/b19-12+InChIKey
COJCPFNVOSMGFV-XDHOZWIPSA-NSynonyms
425659-55-8(5E)1(3BROMOPHENYL)5((3METHOXY5PROP2ENYL4PROP2YNOXYPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)1(3BROMOPHENYL)5(3METHOXY5(PROP2EN1YL)4(PROP2YN1YLOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
425659558
C#CCOc1c(CC=C)cc(cc1OC)C=C1C(=O)NC(=O)N(C1=O)c1cccc(c1)Br
COC1=CC(=CC(=C1OCC#C)CC=C)C=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Br
InChI=1SC24H19BrN2O5c147161115(1320(313)21(16)321052)121922(28)2624(30)27(23(19)29)1896817(25)1418h246891114H1710H23H3(H262830)b1912+
MFCD03134896
ZINC000002785220
ZINC02785220
ZINC2785220
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