Vitas-M small molecule compound
10a-{(E)-2-[3-ethoxy-4-(pentyloxy)phenyl]ethenyl}-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2-ol
Catalog ID
STL535606
SMILES CCCCCOc1ccc(cc1OCC)/C=C/C12N=C(O)CCN1c1c(C2(C)C)cccc1
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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 C28H36N2O3 MW 448.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O3/c1-5-7-10-19-33-24-14-13-21(20-25(24)32-6-2)15-17-28-27(3,4)22-11-8-9-12-23(22)30(28)18-16-26(31)29-28/h8-9,11-15,17,20H,5-7,10,16,18-19H2,1-4H3,(H,29,31)/b17-15+InChIKey
MBFGSOVOGFPPMA-BMRADRMJSA-NSynonyms
10~(a)((~(E))2(3ethoxy4pentoxyphenyl)ethenyl)1010dimethyl34dihydro1~(H)pyrimido(12a)indol2one
10a((E)2(3ethoxy4(pentyloxy)phenyl)ethenyl)1010dimethyl341010atetrahydropyrimido(12a)indol2ol
5903638
InChI=1SC28H36N2O3c15710193324141321(2025(24)3262)15172827(34)2211891223(22)30(28)181626(31)2928h8911151720H5710161819H214H3(H2931)b1715+
MFCD31754080
ZINC000002108745
ZINC000008918081
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