Vitas-M small molecule compound
ethyl 6-bromo-5-hydroxy-1-(4-methoxyphenyl)-2-methyl-4-(pyrrolidin-1-ylmethyl)-1H-indole-3-carboxylate
Catalog ID
STK689089
SMILES CCOC(=O)c1c(C)n(c2c1c(CN1CCCC1)c(O)c(c2)Br)c1ccc(cc1)OC
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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 C24H27BrN2O4 MW 487.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27BrN2O4/c1-4-31-24(29)21-15(2)27(16-7-9-17(30-3)10-8-16)20-13-19(25)23(28)18(22(20)21)14-26-11-5-6-12-26/h7-10,13,28H,4-6,11-12,14H2,1-3H3InChIKey
NMBRMSKZKYEEQS-UHFFFAOYSA-NSynonyms
6bromo3ethoxycarbonyl1(4methoxyphenyl)2methyl4(pyrrolidin1ium1ylmethyl)indol5olate
CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)C(NH+)3CCCC3)(O))Br)C4=CC=C(C=C4)OC)C
ethyl6bromo5hydroxy1(4methoxyphenyl)2methyl4(pyrrolidin1ylmethyl)1Hindole3carboxylate
ETHYL6BROMO5HYDROXY1(4METHOXYPHENYL)2METHYL4(PYRROLIDIN1YLMETHYL)INDOLE3CARBOXYLATE
InChI=1SC24H27BrN2O4c143124(29)2115(2)27(167917(303)10816)201319(25)23(28)18(22(20)21)142611561226h7101328H46111214H213H3
MFCD07800356
ZINC000012413722
ZINC12413722
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