Vitas-M small molecule compound
4-ethoxy-N-({4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]phenyl}carbamothioyl)-3-nitrobenzamide
Catalog ID
STK344913
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccco1
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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 C25H25N5O6S MW 523.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O6S/c1-2-35-21-10-5-17(16-20(21)30(33)34)23(31)27-25(37)26-18-6-8-19(9-7-18)28-11-13-29(14-12-28)24(32)22-4-3-15-36-22/h3-10,15-16H,2,11-14H2,1H3,(H2,26,27,31,37)InChIKey
JYUJAVRTUNATAN-UHFFFAOYSA-NSynonyms
1(4ETHOXY3NITROBENZOYL)3(4(4(FURAN2CARBONYL)PIPERAZIN1YL)PHENYL)THIOUREA
4ethoxyN((4(4(furan2carbonyl)piperazin1yl)phenyl)carbamothioyl)3nitrobenzamide
4ethoxyN((4(4(furan2ylcarbonyl)piperazin1yl)phenyl)carbamothioyl)3nitrobenzamide
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CO4)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1ccc(cc1)N1CCN(CC1)C(=O)c1ccco1
InChI=1SC25H25N5O6Sc12352110517(1620(21)30(33)34)23(31)2725(37)26186819(9718)28111329(141228)24(32)2243153622h3101516H21114H21H3(H226273137)
MFCD07148591
ZINC000012855925
ZINC12855925
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