Vitas-M small molecule compound
N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-3,4,6-trimethyl-1-benzofuran-2-carboxamide
Catalog ID
STL204699
SMILES COc1ccc(cc1)C(N1CCCCCC1)CNC(=O)c1oc2c(c1C)c(C)cc(c2)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 C27H34N2O3 MW 434.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O3/c1-18-15-19(2)25-20(3)26(32-24(25)16-18)27(30)28-17-23(29-13-7-5-6-8-14-29)21-9-11-22(31-4)12-10-21/h9-12,15-16,23H,5-8,13-14,17H2,1-4H3,(H,28,30)InChIKey
MDHBJZCFSYVYRK-UHFFFAOYSA-NSynonyms
CC1=CC(=C2C(=C(OC2=C1)C(=O)NCC(C3=CC=C(C=C3)OC)N4CCCCCC4)C)C
InChI=1SC27H34N2O3c1181519(2)2520(3)26(3224(25)1618)27(30)281723(291375681429)2191122(314)121021h912151623H58131417H214H3(H2830)
MFCD12915413
N(2(azepan1yl)2(4methoxyphenyl)ethyl)346trimethyl1benzofuran2carboxamide
ZINC000027583204
ZINC000027583210
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