Vitas-M small molecule compound
3,4,5-triethoxy-N-({4-[4-(methylsulfonyl)piperazin-1-yl]phenyl}carbamothioyl)benzamide
Catalog ID
STK355826
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)NC(=S)Nc1ccc(cc1)N1CCN(CC1)S(=O)(=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 C25H34N4O6S2 MW 550.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34N4O6S2/c1-5-33-21-16-18(17-22(34-6-2)23(21)35-7-3)24(30)27-25(36)26-19-8-10-20(11-9-19)28-12-14-29(15-13-28)37(4,31)32/h8-11,16-17H,5-7,12-15H2,1-4H3,(H2,26,27,30,36)InChIKey
ZCJKCUDVHWHXSV-UHFFFAOYSA-NSynonyms
345TRIETHOXYN((4(4(METHYLSULFONYL)PIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
345TRIETHOXYN((4(4METHYLSULFONYLPIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCN(CC3)S(=O)(=O)C
InChI=1SC25H34N4O6S2c1533211618(1722(3462)23(21)3573)24(30)2725(36)261981020(11919)28121429(151328)37(431)32h8111617H571215H214H3(H226273036)
MFCD04078846
ZINC000100372343
ZINC100372343
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