Vitas-M small molecule compound
N-[5-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]-3-nitro-4-(pyrrolidin-1-yl)benzamide
Catalog ID
STK892049
SMILES CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCC1)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 C23H23N7O3S MW 477.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N7O3S/c1-3-20-25-26-23-29(20)27-22(34-23)16-7-6-14(2)17(12-16)24-21(31)15-8-9-18(19(13-15)30(32)33)28-10-4-5-11-28/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,24,31)InChIKey
YTJDUAUGGOCOOF-UHFFFAOYSA-NSynonyms
CCC1=NN=C2N1N=C(S2)C3=CC(=C(C=C3)C)NC(=O)C4=CC(=C(C=C4)N5CCCC5)(N+)(=O)(O)
CCc1nnc2n1nc(s2)c1ccc(c(c1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCCC1)C
InChI=1SC23H23N7O3Sc132025262329(20)2722(3423)167614(2)17(1216)2421(31)158918(19(1315)30(32)33)2810451128h691213H351011H212H3(H2431)
MFCD05829749
N(5(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)2methylphenyl)3nitro4(pyrrolidin1yl)benzamide
N(5(3ETHYL(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)2METHYLPHENYL)3NITRO4PYRROLIDIN1YLBENZAMIDE
ZINC000016162660
ZINC16162660
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