Vitas-M small molecule compound
N-{[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]carbamothioyl}-3-propoxybenzamide
Catalog ID
STK254841
SMILES CCCOc1cccc(c1)C(=O)NC(=S)Nc1ccc(c(c1)Cl)N1CCN(CC1)C(=O)CCC
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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 C25H31ClN4O3S MW 503.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31ClN4O3S/c1-3-6-23(31)30-13-11-29(12-14-30)22-10-9-19(17-21(22)26)27-25(34)28-24(32)18-7-5-8-20(16-18)33-15-4-2/h5,7-10,16-17H,3-4,6,11-15H2,1-2H3,(H2,27,28,32,34)InChIKey
YAXWIARQGMSNFS-UHFFFAOYSA-NSynonyms
CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCC)Cl
InChI=1SC25H31ClN4O3Sc13623(31)30131129(121430)2210919(1721(22)26)2725(34)2824(32)1875820(1618)331542h57101617H3461115H212H3(H227283234)
MFCD03922628
N((4(4BUTANOYLPIPERAZIN1YL)3CHLOROPHENYL)CARBAMOTHIOYL)3PROPOXYBENZAMIDE
ZINC000005946053
ZINC05946053
ZINC5946053
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