Vitas-M small molecule compound
methyl 5-bromo-3-({2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Catalog ID
STK535769
SMILES COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCN(CC1)c1cc(Cl)ccc1C)C)cc(cc2)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 C24H26BrClN4O3 MW 533.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26BrClN4O3/c1-14-4-6-17(26)13-20(14)30-10-8-29(9-11-30)15(2)23(31)28-21-18-12-16(25)5-7-19(18)27-22(21)24(32)33-3/h4-7,12-13,15,27H,8-11H2,1-3H3,(H,28,31)InChIKey
JYNRWUAJNOTIRF-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(C)C(=O)NC3=C(NC4=C3C=C(C=C4)Br)C(=O)OC
COC(=O)c1(nH)c2c(c1NC(=O)C(N1CCN(CC1)c1cc(Cl)ccc1C)C)cc(cc2)Br
InChI=1SC24H26BrClN4O3c1144617(26)1320(14)3010829(91130)15(2)23(31)2821181216(25)5719(18)2722(21)24(32)333h4712131527H811H213H3(H2831)
methyl5bromo3((2(4(5chloro2methylphenyl)piperazin1yl)propanoyl)amino)1Hindole2carboxylate
methyl5bromo3(2(4(5chloro2methylphenyl)piperazin1yl)propanamido)1Hindole2carboxylate
METHYL5BROMO3(2(4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)PROPANOYLAMINO)1HINDOLE2CARBOXYLATE
MFCD02989389
ZINC000097951093
ZINC000097951094
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