Vitas-M small molecule compound

(5Z)-1-(2-fluorophenyl)-5-[({2-[2-methyl-7-(trifluoromethyl)-1H-indol-3-yl]ethyl}amino)(phenylamino)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STL441723
SMILES O=C1NC(=O)N(C(=O)/C/1=C(\Nc1ccccc1)/NCCc1c(C)[nH]c2c1cccc2C(F)(F)F)c1ccccc1F

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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 C29H23F4N5O3 MW 565.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23F4N5O3/c1-16-18(19-10-7-11-20(24(19)35-16)29(31,32)33)14-15-34-25(36-17-8-3-2-4-9-17)23-26(39)37-28(41)38(27(23)40)22-13-6-5-12-21(22)30/h2-13,34-36H,14-15H2,1H3,(H,37,39,41)/b25-23-
InChIKey
IYLSOSWKKQLIHR-BZZOAKBMSA-N
Synonyms

(5Z)1(2fluorophenyl)5(((2(2methyl7(trifluoromethyl)1Hindol3yl)ethyl)amino)(phenylamino)methylidene)pyrimidine246(1H3H5H)trione
(5Z)5(anilino(2(2methyl7(trifluoromethyl)1Hindol3yl)ethylamino)methylidene)1(2fluorophenyl)13diazinane246trione
CC1=C(C2=C(N1)C(=CC=C2)C(F)(F)F)CCNC(=C3C(=O)NC(=O)N(C3=O)C4=CC=CC=C4F)NC5=CC=CC=C5
InChI=1SC29H23F4N5O3c11618(191071120(24(19)3516)29(3132)33)14153425(36178324917)2326(39)3728(41)38(27(23)40)2213651221(22)30h2133436H1415H21H3(H373941)b2523
MFCD08060427
O=C1NC(=O)N(C(=O)C1=C(Nc1ccccc1)NCCc1c(C)(nH)c2c1cccc2C(F)(F)F)c1ccccc1F
ZINC000008777873
ZINC8777873

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Available files

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