Vitas-M small molecule compound
10a-{(E)-2-[4-(benzyloxy)-3-ethoxyphenyl]ethenyl}-8,10,10-trimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Catalog ID
STL528632
SMILES CCOc1cc(ccc1OCc1ccccc1)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cc(cc1)C
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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 C31H34N2O3 MW 482.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N2O3/c1-5-35-28-20-23(12-14-27(28)36-21-24-9-7-6-8-10-24)15-17-31-30(3,4)25-19-22(2)11-13-26(25)33(31)18-16-29(34)32-31/h6-15,17,19-20H,5,16,18,21H2,1-4H3,(H,32,34)/b17-15+InChIKey
JLQZVGCINVAEPY-BMRADRMJSA-NSynonyms
(E)10a(4(benzyloxy)3ethoxystyryl)81010trimethyl341010atetrahydropyrimido(12a)indol2(1H)one
10~(a)((~(E))2(3ethoxy4phenylmethoxyphenyl)ethenyl)81010trimethyl34dihydro1~(H)pyrimido(12a)indol2one
10a((E)2(4(benzyloxy)3ethoxyphenyl)ethenyl)81010trimethyl341010atetrahydropyrimido(12a)indol2(1H)one
6216636
CCOc1cc(ccc1OCc1ccccc1)C=CC12NC(=O)CCN1c1c(C2(C)C)cc(cc1)C
InChI=1SC31H34N2O3c1535282023(121427(28)36212497681024)15173130(34)251922(2)111326(25)33(31)181629(34)3231h615171920H5161821H214H3(H3234)b1715+
MFCD06493518
ZINC000002129947
ZINC000008918629
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