Vitas-M small molecule compound

(5E)-3-cycloheptyl-6-hydroxy-5-({[3-(trifluoromethyl)phenyl]amino}methylidene)pyrimidine-2,4(3H,5H)-dione

Catalog ID
STL052490
SMILES O=C1N=C(O)/C(=C\Nc2cccc(c2)C(F)(F)F)/C(=O)N1C1CCCCCC1

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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 C19H20F3N3O3 MW 395.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20F3N3O3/c20-19(21,22)12-6-5-7-13(10-12)23-11-15-16(26)24-18(28)25(17(15)27)14-8-3-1-2-4-9-14/h5-7,10-11,14,23H,1-4,8-9H2,(H,24,26,28)/b15-11+
InChIKey
JJUXUMQDNJTBOP-RVDMUPIBSA-N
Synonyms

(5E)1CYCLOHEPTYL5((3(TRIFLUOROMETHYL)ANILINO)METHYLIDENE)13DIAZINANE246TRIONE
(5E)3cycloheptyl6hydroxy5(((3(trifluoromethyl)phenyl)amino)methylidene)pyrimidine24(3H5H)dione
C1CCCC(CC1)N2C(=O)C(=CNC3=CC=CC(=C3)C(F)(F)F)C(=O)NC2=O
InChI=1SC19H20F3N3O3c2019(2122)1265713(1012)23111516(26)2418(28)25(17(15)27)1483124914h5710111423H1489H2(H242628)b1511+
MFCD05727826
O=C1N=C(O)C(=CNc2cccc(c2)C(F)(F)F)C(=O)N1C1CCCCCC1
ZINC000005050924
ZINC05050924
ZINC5050924

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Available files

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