Vitas-M small molecule compound
ethyl 6-bromo-1-(3-bromophenyl)-5-hydroxy-2-methyl-4-{[4-(2-methylphenyl)piperazin-1-yl]methyl}-1H-indole-3-carboxylate
Catalog ID
STK689002
SMILES CCOC(=O)c1c2c(CN3CCN(CC3)c3ccccc3C)c(O)c(cc2n(c1C)c1cccc(c1)Br)Br
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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 C30H31Br2N3O3 MW 641.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31Br2N3O3/c1-4-38-30(37)27-20(3)35(22-10-7-9-21(31)16-22)26-17-24(32)29(36)23(28(26)27)18-33-12-14-34(15-13-33)25-11-6-5-8-19(25)2/h5-11,16-17,36H,4,12-15,18H2,1-3H3InChIKey
IMWONKFNAURKHZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN3CCN(CC3)C4=CC=CC=C4C)O)Br)C5=CC(=CC=C5)Br)C
ETHYL6BROMO1(3BROMOPHENYL)5HYDROXY2METHYL4((4(2METHYLPHENYL)PIPERAZIN1YL)METHYL)1HINDOLE3CARBOXYLATE
ETHYL6BROMO1(3BROMOPHENYL)5HYDROXY2METHYL4((4(2METHYLPHENYL)PIPERAZIN1YL)METHYL)INDOLE3CARBOXYLATE
InChI=1SC30H31Br2N3O3c143830(37)2720(3)35(22107921(31)1622)261724(32)29(36)23(28(26)27)1833121434(151333)251165819(25)2h511161736H4121518H213H3
MFCD07800144
ZINC000150390118
ZINC150390118
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