Vitas-M small molecule compound
10a-{(E)-2-[4-(benzyloxy)-3-ethoxyphenyl]ethenyl}-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Catalog ID
STL004850
SMILES CCOc1cc(ccc1OCc1ccccc1)/C=C/C12NC(=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 C30H32N2O3 MW 468.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O3/c1-4-34-27-20-22(14-15-26(27)35-21-23-10-6-5-7-11-23)16-18-30-29(2,3)24-12-8-9-13-25(24)32(30)19-17-28(33)31-30/h5-16,18,20H,4,17,19,21H2,1-3H3,(H,31,33)/b18-16+InChIKey
QNHFJLHYLONUDG-FBMGVBCBSA-NSynonyms
(E)10a(4(benzyloxy)3ethoxystyryl)1010dimethyl341010atetrahydropyrimido(12a)indol2(1H)one
10a((E)2(3ethoxy4phenylmethoxyphenyl)ethenyl)1010dimethyl34dihydro1Hpyrimido(12a)indol2one
10a((E)2(4(benzyloxy)3ethoxyphenyl)ethenyl)1010dimethyl341010atetrahydropyrimido(12a)indol2(1H)one
CCOC1=C(C=CC(=C1)C=CC23C(C4=CC=CC=C4N2CCC(=O)N3)(C)C)OCC5=CC=CC=C5
CCOc1cc(ccc1OCc1ccccc1)C=CC12NC(=O)CCN1c1c(C2(C)C)cccc1
InChI=1SC30H32N2O3c1434272022(141526(27)352123106571123)16183029(23)2412891325(24)32(30)191728(33)3130h5161820H4171921H213H3(H3133)b1816+
MFCD05682376
ZINC000009015778
ZINC000009015779
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