Vitas-M small molecule compound
10a-{(E)-2-[3-(4-chloro-3-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]ethenyl}-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2-ol
Catalog ID
STK641375
SMILES COc1cc(ccc1Cl)c1nn(cc1/C=C/C12N=C(O)CCN1c1c(C2(C)C)cccc1)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 C31H29ClN4O2 MW 525.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29ClN4O2/c1-30(2)24-11-7-8-12-26(24)35-18-16-28(37)33-31(30,35)17-15-22-20-36(23-9-5-4-6-10-23)34-29(22)21-13-14-25(32)27(19-21)38-3/h4-15,17,19-20H,16,18H2,1-3H3,(H,33,37)/b17-15+InChIKey
QYEJBIMMWZDKDK-BMRADRMJSA-NSynonyms
10a((E)2(3(4chloro3methoxyphenyl)1phenyl1Hpyrazol4yl)ethenyl)1010dimethyl341010atetrahydropyrimido(12a)indol2ol
COc1cc(ccc1Cl)c1nn(cc1C=CC12N=C(O)CCN1c1c(C2(C)C)cccc1)c1ccccc1
MFCD18162634
ZINC000002450243
ZINC000009235199
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