Vitas-M small molecule compound
ethyl 6-bromo-1-butyl-5-hydroxy-2-methyl-4-(pyrrolidin-1-ylmethyl)-1H-indole-3-carboxylate
Catalog ID
STK685839
SMILES CCCCn1c(C)c(c2c1cc(Br)c(c2CN1CCCC1)O)C(=O)OCC
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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 C21H29BrN2O3 MW 437.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29BrN2O3/c1-4-6-11-24-14(3)18(21(26)27-5-2)19-15(13-23-9-7-8-10-23)20(25)16(22)12-17(19)24/h12,25H,4-11,13H2,1-3H3InChIKey
SSQCSLXWPZJWTQ-UHFFFAOYSA-NSynonyms
CCCCN1C(=C(C2=C(C(=C(C=C21)Br)O)CN3CCCC3)C(=O)OCC)C
ethyl6bromo1butyl5hydroxy2methyl4(pyrrolidin1ylmethyl)1Hindole3carboxylate
ETHYL6BROMO1BUTYL5HYDROXY2METHYL4(PYRROLIDIN1YLMETHYL)INDOLE3CARBOXYLATE
InChI=1SC21H29BrN2O3c146112414(3)18(21(26)2752)1915(13239781023)20(25)16(22)1217(19)24h1225H41113H213H3
MFCD06013535
ZINC000012411002
ZINC12411002
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