Vitas-M small molecule compound

(5Z)-5-({1-[2-(2,6-dimethylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-1-(4-ethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK550794
SMILES CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2cn(c3c2cccc3)CCOc2c(C)cccc2C)/C1=O

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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 C31H29N3O4 MW 507.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O4/c1-4-22-12-14-24(15-13-22)34-30(36)26(29(35)32-31(34)37)18-23-19-33(27-11-6-5-10-25(23)27)16-17-38-28-20(2)8-7-9-21(28)3/h5-15,18-19H,4,16-17H2,1-3H3,(H,32,35,37)/b26-18-
InChIKey
CXXGNJUOASELBU-ITYLOYPMSA-N
Synonyms
799779-98-9
(5Z)5((1(2(26dimethylphenoxy)ethyl)1Hindol3yl)methylidene)1(4ethylphenyl)pyrimidine246(1H3H5H)trione
(5Z)5((1(2(26DIMETHYLPHENOXY)ETHYL)INDOL3YL)METHYLIDENE)1(4ETHYLPHENYL)13DIAZINANE246TRIONE
(Z)5((1(2(26dimethylphenoxy)ethyl)1Hindol3yl)methylene)1(4ethylphenyl)pyrimidine246(1H3H5H)trione
799779989
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CCOC5=C(C=CC=C5C)C)C(=O)NC2=O
CCc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2cn(c3c2cccc3)CCOc2c(C)cccc2C)C1=O
InChI=1SC31H29N3O4c1422121424(151322)3430(36)26(29(35)3231(34)37)18231933(2711651025(23)27)1617382820(2)87921(28)3h5151819H41617H213H3(H323537)b2618
MFCD03673812
ZINC000009076538
ZINC09076538
ZINC9076538

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Available files

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