Vitas-M small molecule compound

5-bromo-N-{[5-chloro-2-(4-propanoylpiperazin-1-yl)phenyl]carbamothioyl}-2-methoxy-3-methylbenzamide

Catalog ID
STK389720
SMILES CCC(=O)N1CCN(CC1)c1ccc(cc1NC(=S)NC(=O)c1cc(Br)cc(c1OC)C)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 C23H26BrClN4O3S MW 553.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26BrClN4O3S/c1-4-20(30)29-9-7-28(8-10-29)19-6-5-16(25)13-18(19)26-23(33)27-22(31)17-12-15(24)11-14(2)21(17)32-3/h5-6,11-13H,4,7-10H2,1-3H3,(H2,26,27,31,33)
InChIKey
MRBGDXFMDRITFZ-UHFFFAOYSA-N
Synonyms

5bromoN((5chloro2(4propanoylpiperazin1yl)phenyl)carbamothioyl)2methoxy3methylbenzamide
CCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=S)NC(=O)C3=CC(=CC(=C3OC)C)Br
InChI=1SC23H26BrClN4O3Sc1420(30)299728(81029)196516(25)1318(19)2623(33)2722(31)171215(24)1114(2)21(17)323h561113H4710H213H3(H226273133)
MFCD06006026
ZINC000059620398
ZINC59620398

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Available files

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