Vitas-M small molecule compound
(5E)-5-{[1-(2-chlorobenzyl)-2,3-dihydro-1H-indol-5-yl]methylidene}-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STL057568
SMILES C=CCN1C(=O)N=C(/C(=C\c2ccc3c(c2)CCN3Cc2ccccc2Cl)/C1=O)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 C23H20ClN3O3 MW 421.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN3O3/c1-2-10-27-22(29)18(21(28)25-23(27)30)13-15-7-8-20-16(12-15)9-11-26(20)14-17-5-3-4-6-19(17)24/h2-8,12-13H,1,9-11,14H2,(H,25,28,30)/b18-13+InChIKey
ORIHWWVJHDKKCI-QGOAFFKASA-NSynonyms
843626-68-6(5E)5((1((2CHLOROPHENYL)METHYL)23DIHYDROINDOL5YL)METHYLIDENE)1PROP2ENYL13DIAZINANE246TRIONE
(5E)5((1(2chlorobenzyl)23dihydro1Hindol5yl)methylidene)6hydroxy3(prop2en1yl)pyrimidine24(3H5H)dione
843626686
C=CCN1C(=O)C(=CC2=CC3=C(C=C2)N(CC3)CC4=CC=CC=C4Cl)C(=O)NC1=O
C=CCN1C(=O)N=C(C(=Cc2ccc3c(c2)CCN3Cc2ccccc2Cl)C1=O)O
InChI=1SC23H20ClN3O3c12102722(29)18(21(28)2523(27)30)1315782016(1215)91126(20)1417534619(17)24h281213H191114H2(H252830)b1813+
MFCD07199129
ZINC000009010119
ZINC000033930503
ZINC09010119
ZINC9010119
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