Vitas-M small molecule compound
5-bromo-2-methoxy-3-methyl-N-({2-[4-(phenylcarbonyl)piperazin-1-yl]phenyl}carbamothioyl)benzamide
Catalog ID
STK336691
SMILES COc1c(C)cc(cc1C(=O)NC(=S)Nc1ccccc1N1CCN(CC1)C(=O)c1ccccc1)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 C27H27BrN4O3S MW 567.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27BrN4O3S/c1-18-16-20(28)17-21(24(18)35-2)25(33)30-27(36)29-22-10-6-7-11-23(22)31-12-14-32(15-13-31)26(34)19-8-4-3-5-9-19/h3-11,16-17H,12-15H2,1-2H3,(H2,29,30,33,36)InChIKey
JZOORLIHTRUAAP-UHFFFAOYSA-NSynonyms
1(2(4BENZOYLPIPERAZIN1YL)PHENYL)3(5BROMO2METHOXY3METHYLBENZOYL)THIOUREA
5bromo2methoxy3methylN((2(4(phenylcarbonyl)piperazin1yl)phenyl)carbamothioyl)benzamide
CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2N3CCN(CC3)C(=O)C4=CC=CC=C4)OC
InChI=1SC27H27BrN4O3Sc1181620(28)1721(24(18)352)25(33)3027(36)292210671123(22)31121432(151331)26(34)198435919h3111617H1215H212H3(H229303336)
MFCD05995428
N((2(4BENZOYLPIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)5BROMO2METHOXY3METHYLBENZAMIDE
ZINC000059608359
ZINC59608359
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