Vitas-M small molecule compound

5-[(1-{2-[2-(butan-2-yl)phenoxy]ethyl}-1H-indol-3-yl)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK039055
SMILES CCC(c1ccccc1OCCn1cc(c2c1cccc2)C=C1C(=O)N(C)C(=O)N(C1=O)C)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 C27H29N3O4 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4/c1-5-18(2)20-10-7-9-13-24(20)34-15-14-30-17-19(21-11-6-8-12-23(21)30)16-22-25(31)28(3)27(33)29(4)26(22)32/h6-13,16-18H,5,14-15H2,1-4H3
InChIKey
INZKNNZSRHRPBU-UHFFFAOYSA-N
Synonyms
732247-70-0
5((1(2(2(BUTAN2YL)PHENOXY)ETHYL)1HINDOL3YL)METHYLIDENE)13DIMETHYLPYRIMIDINE246(1H3H5H)TRIONE
5((1(2(2(secbutyl)phenoxy)ethyl)1Hindol3yl)methylene)13dimethylpyrimidine246(1H3H5H)trione
5((1(2(2BUTAN2YLPHENOXY)ETHYL)INDOL3YL)METHYLIDENE)13DIMETHYL13DIAZINANE246TRIONE
732247700
CCC(C)C1=CC=CC=C1OCCN2C=C(C3=CC=CC=C32)C=C4C(=O)N(C(=O)N(C4=O)C)C
CCC(c1ccccc1OCCn1cc(c2c1cccc2)C=C1C(=O)N(C)C(=O)N(C1=O)C)C
InChI=1SC27H29N3O4c1518(2)2010791324(20)341514301719(2111681223(21)30)162225(31)28(3)27(33)29(4)26(22)32h6131618H51415H214H3
MFCD03676475
STK039055
ZINC000002216162
ZINC000002216165

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Available files

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