Vitas-M small molecule compound
5-bromo-2-methoxy-3-methyl-N-{[2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}benzamide
Catalog ID
STK163183
SMILES COc1c(C)cc(cc1C(=O)NC(=S)Nc1ccccc1N1CCN(CC1)C)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 C21H25BrN4O2S MW 477.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25BrN4O2S/c1-14-12-15(22)13-16(19(14)28-3)20(27)24-21(29)23-17-6-4-5-7-18(17)26-10-8-25(2)9-11-26/h4-7,12-13H,8-11H2,1-3H3,(H2,23,24,27,29)InChIKey
FZWWFZNNKUHOQW-UHFFFAOYSA-NSynonyms
5BROMO2METHOXY3METHYLN((2(4METHYLPIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2N3CCN(CC3)C)OC
InChI=1SC21H25BrN4O2Sc1141215(22)1316(19(14)283)20(27)2421(29)2317645718(17)2610825(2)91126h471213H811H213H3(H223242729)
MFCD05832271
ZINC000009846184
ZINC9846184
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