Vitas-M small molecule compound
N-({5-chloro-2-[4-(phenylcarbonyl)piperazin-1-yl]phenyl}carbamothioyl)-2,6-dimethoxybenzamide
Catalog ID
STK397693
SMILES COc1cccc(c1C(=O)NC(=S)Nc1cc(Cl)ccc1N1CCN(CC1)C(=O)c1ccccc1)OC
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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 C27H27ClN4O4S MW 539.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN4O4S/c1-35-22-9-6-10-23(36-2)24(22)25(33)30-27(37)29-20-17-19(28)11-12-21(20)31-13-15-32(16-14-31)26(34)18-7-4-3-5-8-18/h3-12,17H,13-16H2,1-2H3,(H2,29,30,33,37)InChIKey
KGTDUWIEEQTBLW-UHFFFAOYSA-NSynonyms
COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=C(C=CC(=C2)Cl)N3CCN(CC3)C(=O)C4=CC=CC=C4
InChI=1SC27H27ClN4O4Sc13522961023(362)24(22)25(33)3027(37)29201719(28)111221(20)31131532(161431)26(34)187435818h31217H1316H212H3(H229303337)
MFCD06759150
N((2(4benzoylpiperazin1yl)5chlorophenyl)carbamothioyl)26dimethoxybenzamide
N((5chloro2(4(phenylcarbonyl)piperazin1yl)phenyl)carbamothioyl)26dimethoxybenzamide
ZINC000100404786
ZINC100404786
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