Vitas-M small molecule compound
5-bromo-2-chloro-N-{[5-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl}benzamide
Catalog ID
STK344619
SMILES CCC(=O)N1CCN(CC1)c1ccc(cc1NC(=S)NC(=O)c1cc(Br)ccc1Cl)Cl
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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 C21H21BrCl2N4O2S MW 544.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrCl2N4O2S/c1-2-19(29)28-9-7-27(8-10-28)18-6-4-14(23)12-17(18)25-21(31)26-20(30)15-11-13(22)3-5-16(15)24/h3-6,11-12H,2,7-10H2,1H3,(H2,25,26,30,31)InChIKey
AETXHCDNGSCJMB-UHFFFAOYSA-NSynonyms
1(5BROMO2CHLOROBENZOYL)3(5CHLORO2(4PROPIONYLPIPERAZIN1YL)PHENYL)THIOUREA
5bromo2chloroN((5chloro2(4propanoylpiperazin1yl)phenyl)carbamothioyl)benzamide
CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)Cl
InChI=1SC21H21BrCl2N4O2Sc1219(29)289727(81028)186414(23)1217(18)2521(31)2620(30)151113(22)3516(15)24h361112H2710H21H3(H225263031)
MFCD05832096
ZINC000059612586
ZINC59612586
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