Vitas-M small molecule compound
N-[5-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]-4-(morpholin-4-yl)-3-nitrobenzamide
Catalog ID
STK892052
SMILES CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1)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 C23H23N7O4S MW 493.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N7O4S/c1-3-20-25-26-23-29(20)27-22(35-23)16-5-4-14(2)17(12-16)24-21(31)15-6-7-18(19(13-15)30(32)33)28-8-10-34-11-9-28/h4-7,12-13H,3,8-11H2,1-2H3,(H,24,31)InChIKey
GUIADRCHQXDKBH-UHFFFAOYSA-NSynonyms
CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)C)NC(=O)C4=CC(=C(C=C4)N5CCOCC5)(N+)(=O)(O)
CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCOCC1)C
InChI=1SC23H23N7O4Sc132025262329(20)2722(3523)165414(2)17(1216)2421(31)156718(19(1315)30(32)33)288103411928h471213H3811H212H3(H2431)
MFCD05829767
N(5(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)2methylphenyl)4(morpholin4yl)3nitrobenzamide
N(5(3ETHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2METHYLPHENYL)4MORPHOLIN4YL3NITROBENZAMIDE
ZINC000016162662
ZINC16162662
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