Vitas-M small molecule compound

(5Z)-5-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylidene}-1-phenylpyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STL419366
SMILES O=C1NC(=O)N(C(=O)/C/1=C\c1cn(c2c1cccc2)CCOc1ccccc1)c1ccccc1

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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 C27H21N3O4 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O4/c31-25-23(26(32)30(27(33)28-25)20-9-3-1-4-10-20)17-19-18-29(24-14-8-7-13-22(19)24)15-16-34-21-11-5-2-6-12-21/h1-14,17-18H,15-16H2,(H,28,31,33)/b23-17-
InChIKey
ZCHBHOFJQHOMNB-QJOMJCCJSA-N
Synonyms

(5Z)5((1(2phenoxyethyl)1Hindol3yl)methylidene)1phenylpyrimidine246(1H3H5H)trione
(5Z)5((1(2phenoxyethyl)indol3yl)methylidene)1phenyl13diazinane246trione
C1=CC=C(C=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CCOC5=CC=CC=C5)C(=O)NC2=O
InChI=1SC27H21N3O4c312523(26(32)30(27(33)2825)2093141020)17191829(2414871322(19)24)15163421115261221h1141718H1516H2(H283133)b2317
MFCD30707322
O=C1NC(=O)N(C(=O)C1=Cc1cn(c2c1cccc2)CCOc1ccccc1)c1ccccc1
ZINC000103657415
ZINC103657415

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Available files

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