Vitas-M small molecule compound

(5Z)-1-[4-(butan-2-yl)phenyl]-5-{[1-(2-chlorobenzyl)-1H-indol-3-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK551028
SMILES CCC(c1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccccc2Cl)/C1=O)C

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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 C30H26ClN3O3 MW 512.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26ClN3O3/c1-3-19(2)20-12-14-23(15-13-20)34-29(36)25(28(35)32-30(34)37)16-22-18-33(27-11-7-5-9-24(22)27)17-21-8-4-6-10-26(21)31/h4-16,18-19H,3,17H2,1-2H3,(H,32,35,37)/b25-16-
InChIKey
CHCBKVKAMQAIBB-XYGWBWBKSA-N
Synonyms
799787-27-2
(5Z)1(4(butan2yl)phenyl)5((1(2chlorobenzyl)1Hindol3yl)methylidene)pyrimidine246(1H3H5H)trione
(5Z)1(4BUTAN2YLPHENYL)5((1((2CHLOROPHENYL)METHYL)INDOL3YL)METHYLIDENE)13DIAZINANE246TRIONE
(Z)1(4(secbutyl)phenyl)5((1(2chlorobenzyl)1Hindol3yl)methylene)pyrimidine246(1H3H5H)trione
799787272
CCC(C)C1=CC=C(C=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5Cl)C(=O)NC2=O
CCC(c1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cn(c3c2cccc3)Cc2ccccc2Cl)C1=O)C
InChI=1SC30H26ClN3O3c1319(2)20121423(151320)3429(36)25(28(35)3230(34)37)16221833(271175924(22)27)17218461026(21)31h4161819H317H212H3(H323537)b2516
MFCD03675855
ZINC000009076351
ZINC000009076352

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Available files

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