Vitas-M small molecule compound
ethyl 2-(3,4-dimethylphenyl)-4-(3-ethoxy-2-hydroxyphenyl)-1,5,9-triazaspiro[5.5]undec-1-ene-9-carboxylate
Catalog ID
STL193270
SMILES CCOC(=O)N1CCC2(CC1)N=C(CC(N2)c1cccc(c1O)OCC)c1ccc(c(c1)C)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 C27H35N3O4 MW 465.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35N3O4/c1-5-33-24-9-7-8-21(25(24)31)23-17-22(20-11-10-18(3)19(4)16-20)28-27(29-23)12-14-30(15-13-27)26(32)34-6-2/h7-11,16,23,29,31H,5-6,12-15,17H2,1-4H3InChIKey
VLTYMCONXYVNPT-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC(=C1O)C2CC(=NC3(N2)CCN(CC3)C(=O)OCC)C4=CC(=C(C=C4)C)C
ethyl2(34dimethylphenyl)4(3ethoxy2hydroxyphenyl)159triazaspiro(55)undec1ene9carboxylate
ethyl4(34dimethylphenyl)2(3ethoxy2hydroxyphenyl)159triazaspiro(55)undec4ene9carboxylate
InChI=1SC27H35N3O4c15332497821(25(24)31)231722(20111018(3)19(4)1620)2827(2923)121430(151327)26(32)3462h71116232931H56121517H214H3
MFCD22390953
ZINC000065298458
ZINC000065298462
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