Vitas-M small molecule compound

2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-fluoro-3-nitrophenyl)acetamide

Catalog ID
STK123836
SMILES COc1cc(ccc1OC)c1nnc(n1c1ccccc1)SCC(=O)Nc1ccc(c(c1)[N+](=O)[O-])F

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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 C24H20FN5O5S MW 509.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20FN5O5S/c1-34-20-11-8-15(12-21(20)35-2)23-27-28-24(29(23)17-6-4-3-5-7-17)36-14-22(31)26-16-9-10-18(25)19(13-16)30(32)33/h3-13H,14H2,1-2H3,(H,26,31)
InChIKey
LDVAPDRXUQKTLE-UHFFFAOYSA-N
Synonyms
398470-22-9
2((5(34DIMETHOXYPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N(4FLUORO3NITROPHENYL)ACETAMIDE
2((5(34DIMETHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N(4FLUORO3NITROPHENYL)ACETAMIDE
2((5(34dimethoxyphenyl)4phenyl4H124triazol3yl)thio)N(4fluoro3nitrophenyl)acetamide
2(5(34DIMETHOXYPHENYL)4PHENYL(124TRIAZOL3YLTHIO))N(4FLUORO3NITROPHENYL)ACETAMIDE
398470229
COC1=C(C=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=CC(=C(C=C4)F)(N+)(=O)(O))OC
COc1cc(ccc1OC)c1nnc(n1c1ccccc1)SCC(=O)Nc1ccc(c(c1)(N+)(=O)(O))F
InChI=1SC24H20FN5O5Sc1342011815(1221(20)352)23272824(29(23)176435717)361422(31)261691018(25)19(1316)30(32)33h313H14H212H3(H2631)
MFCD00754620
ZINC000001031161
ZINC01031161
ZINC1031161

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Available files

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