Vitas-M small molecule compound
N-[2-(azepan-1-yl)-2-(4-methylphenyl)ethyl]-3,5,6-trimethyl-1-benzofuran-2-carboxamide
Catalog ID
STL210267
SMILES Cc1ccc(cc1)C(N1CCCCCC1)CNC(=O)c1oc2c(c1C)cc(c(c2)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 C27H34N2O2 MW 418.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O2/c1-18-9-11-22(12-10-18)24(29-13-7-5-6-8-14-29)17-28-27(30)26-21(4)23-15-19(2)20(3)16-25(23)31-26/h9-12,15-16,24H,5-8,13-14,17H2,1-4H3,(H,28,30)InChIKey
KWFFYUGFQMTJHB-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C(CNC(=O)C2=C(C3=CC(=C(C=C3O2)C)C)C)N4CCCCCC4
InChI=1SC27H34N2O2c11891122(121018)24(291375681429)172827(30)2621(4)231519(2)20(3)1625(23)3126h912151624H58131417H214H3(H2830)
MFCD12921126
N(2(azepan1yl)2(4methylphenyl)ethyl)356trimethyl1benzofuran2carboxamide
ZINC000028287353
ZINC000028287356
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