Vitas-M small molecule compound
5-[(1-{2-[4-(butan-2-yl)phenoxy]ethyl}-1H-indol-3-yl)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK040834
SMILES CCC(c1ccc(cc1)OCCn1cc(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)19-10-12-21(13-11-19)34-15-14-30-17-20(22-8-6-7-9-24(22)30)16-23-25(31)28(3)27(33)29(4)26(23)32/h6-13,16-18H,5,14-15H2,1-4H3InChIKey
NKWYQFWAUYSWRW-UHFFFAOYSA-NSynonyms
732251-27-35((1(2(4(BUTAN2YL)PHENOXY)ETHYL)1HINDOL3YL)METHYLIDENE)13DIMETHYLPYRIMIDINE246(1H3H5H)TRIONE
5((1(2(4(secbutyl)phenoxy)ethyl)1Hindol3yl)methylene)13dimethylpyrimidine246(1H3H5H)trione
5((1(2(4BUTAN2YLPHENOXY)ETHYL)INDOL3YL)METHYLIDENE)13DIMETHYL13DIAZINANE246TRIONE
732251273
CCC(C)C1=CC=C(C=C1)OCCN2C=C(C3=CC=CC=C32)C=C4C(=O)N(C(=O)N(C4=O)C)C
CCC(c1ccc(cc1)OCCn1cc(c2c1cccc2)C=C1C(=O)N(C)C(=O)N(C1=O)C)C
InChI=1SC27H29N3O4c1518(2)19101221(131119)341514301720(22867924(22)30)162325(31)28(3)27(33)29(4)26(23)32h6131618H51415H214H3
MFCD04005431
STK040834
ZINC000002261235
ZINC000002261236
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