Vitas-M small molecule compound
N-{4-[5-(3-chloro-1-benzothiophen-2-yl)-1,2,4-oxadiazol-3-yl]phenyl}-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Catalog ID
STK784132
SMILES O=C(Cn1ncc(c1)[N+](=O)[O-])Nc1ccc(cc1)c1noc(n1)c1sc2c(c1Cl)cccc2
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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 C21H13ClN6O4S MW 480.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClN6O4S/c22-18-15-3-1-2-4-16(15)33-19(18)21-25-20(26-32-21)12-5-7-13(8-6-12)24-17(29)11-27-10-14(9-23-27)28(30)31/h1-10H,11H2,(H,24,29)InChIKey
JWKLQFCWQIZSMX-UHFFFAOYSA-NSynonyms
C1=CC=C2C(=C1)C(=C(S2)C3=NC(=NO3)C4=CC=C(C=C4)NC(=O)CN5C=C(C=N5)(N+)(=O)(O))Cl
InChI=1SC21H13ClN6O4Sc221815312416(15)3319(18)212520(263221)125713(8612)2417(29)11271014(92327)28(30)31h110H11H2(H2429)
MFCD06619503
N(4(5(3chloro1benzothiophen2yl)124oxadiazol3yl)phenyl)2(4nitro1Hpyrazol1yl)acetamide
N(4(5(3CHLORO1BENZOTHIOPHEN2YL)124OXADIAZOL3YL)PHENYL)2(4NITROPYRAZOL1YL)ACETAMIDE
O=C(Cn1ncc(c1)(N+)(=O)(O))Nc1ccc(cc1)c1noc(n1)c1sc2c(c1Cl)cccc2
ZINC000012360145
ZINC12360145
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