Vitas-M small molecule compound
(5E)-3-(3-chloro-4-methylphenyl)-6-hydroxy-5-[(1-{2-[2-(prop-2-en-1-yl)phenoxy]ethyl}-1H-pyrrol-2-yl)methylidene]pyrimidine-2,4(3H,5H)-dione
Catalog ID
STL150694
SMILES C=CCc1ccccc1OCCn1cccc1/C=C/1\C(=NC(=O)N(C1=O)c1ccc(c(c1)Cl)C)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 C27H24ClN3O4 MW 489.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClN3O4/c1-3-7-19-8-4-5-10-24(19)35-15-14-30-13-6-9-20(30)16-22-25(32)29-27(34)31(26(22)33)21-12-11-18(2)23(28)17-21/h3-6,8-13,16-17H,1,7,14-15H2,2H3,(H,29,32,34)/b22-16+InChIKey
PGZOOXYJTQXUQN-CJLVFECKSA-NSynonyms
578005-55-7(5E)1(3CHLORO4METHYLPHENYL)5((1(2(2PROP2ENYLPHENOXY)ETHYL)PYRROL2YL)METHYLIDENE)13DIAZINANE246TRIONE
(5E)3(3chloro4methylphenyl)6hydroxy5((1(2(2(prop2en1yl)phenoxy)ethyl)1Hpyrrol2yl)methylidene)pyrimidine24(3H5H)dione
578005557
C=CCc1ccccc1OCCn1cccc1C=C1C(=NC(=O)N(C1=O)c1ccc(c(c1)Cl)C)O
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=CN3CCOC4=CC=CC=C4CC=C)C(=O)NC2=O)Cl
InChI=1SC27H24ClN3O4c137198451024(19)35151430136920(30)162225(32)2927(34)31(26(22)33)21121118(2)23(28)1721h368131617H171415H22H3(H293234)b2216+
MFCD04078253
ZINC000009424403
ZINC9424403
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