Vitas-M small molecule compound
N-{[4-(4-acetylpiperazin-1-yl)phenyl]carbamothioyl}-3-bromo-4-methoxybenzamide
Catalog ID
STK323600
SMILES COc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(cc1)N1CCN(CC1)C(=O)C
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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 C21H23BrN4O3S MW 491.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23BrN4O3S/c1-14(27)25-9-11-26(12-10-25)17-6-4-16(5-7-17)23-21(30)24-20(28)15-3-8-19(29-2)18(22)13-15/h3-8,13H,9-12H2,1-2H3,(H2,23,24,28,30)InChIKey
HFUOCGNKCYEDFO-UHFFFAOYSA-NSynonyms
CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)Br
InChI=1SC21H23BrN4O3Sc114(27)2591126(121025)176416(5717)2321(30)2420(28)153819(292)18(22)1315h3813H912H212H3(H223242830)
MFCD02810638
N((4(4acetylpiperazin1yl)phenyl)carbamothioyl)3bromo4methoxybenzamide
ZINC000012379430
ZINC12379430
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