Vitas-M small molecule compound
ethyl 6-bromo-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-2-[(phenylsulfonyl)methyl]-1H-indole-3-carboxylate
Catalog ID
STL334541
SMILES CCOC(=O)c1c(CS(=O)(=O)c2ccccc2)n(c2c1c(CN(C)C)c(O)c(c2)Br)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 C22H25BrN2O5S MW 509.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25BrN2O5S/c1-5-30-22(27)20-18(13-31(28,29)14-9-7-6-8-10-14)25(4)17-11-16(23)21(26)15(19(17)20)12-24(2)3/h6-11,26H,5,12-13H2,1-4H3InChIKey
JFYQRVBFTIWYAP-UHFFFAOYSA-NSynonyms
151455-32-2151455322
CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C)CS(=O)(=O)C3=CC=CC=C3
ethyl2(benzenesulfonylmethyl)6bromo4((dimethylamino)methyl)5hydroxy1methylindole3carboxylate
ETHYL2(BENZENESULFONYLMETHYL)6BROMO4(DIMETHYLAMINOMETHYL)5HYDROXY1METHYLINDOLE3CARBOXYLATE
ETHYL4((DIMETHYLAMINO)METHYL)6BROMO5HYDROXY1METHYL2((PHENYLSULFONYL)METHYL)INDOLE3CARBOXYLATE
ethyl6bromo4((dimethylamino)methyl)5hydroxy1methyl2((phenylsulfonyl)methyl)1Hindole3carboxylate
InChI=1SC22H25BrN2O5Sc153022(27)2018(1331(2829)1497681014)25(4)171116(23)21(26)15(19(17)20)1224(2)3h61126H51213H214H3
MFCD00329502
ZINC000019954949
ZINC19954949
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