Vitas-M small molecule compound
2-fluoro-N-[2-methyl-1-(4-methyl-5-{[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)propyl]benzamide
Catalog ID
STK251256
SMILES CC(C(c1nnc(n1C)SCC(=O)c1cccc(c1)[N+](=O)[O-])NC(=O)c1ccccc1F)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 C22H22FN5O4S MW 471.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FN5O4S/c1-13(2)19(24-21(30)16-9-4-5-10-17(16)23)20-25-26-22(27(20)3)33-12-18(29)14-7-6-8-15(11-14)28(31)32/h4-11,13,19H,12H2,1-3H3,(H,24,30)InChIKey
HDMZEVIOACWNAE-UHFFFAOYSA-NSynonyms
2FLUORON(2METHYL1(4METHYL5((2(3NITROPHENYL)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)PROPYL)BENZAMIDE
2fluoroN(2methyl1(4methyl5(2(3nitrophenyl)2oxoethyl)sulfanyl124triazol3yl)propyl)benzamide
2FLUORON(2METHYL1(4METHYL5(2(3NITROPHENYL)2OXOETHYLSULFANYL)4H(124)TRIAZOL3YL)PROPYL)BENZAMIDE
CC(C(c1nnc(n1C)SCC(=O)c1cccc(c1)(N+)(=O)(O))NC(=O)c1ccccc1F)C
CC(C)C(C1=NN=C(N1C)SCC(=O)C2=CC(=CC=C2)(N+)(=O)(O))NC(=O)C3=CC=CC=C3F
InChI=1SC22H22FN5O4Sc113(2)19(2421(30)169451017(16)23)20252622(27(20)3)331218(29)1476815(1114)28(31)32h4111319H12H213H3(H2430)
MFCD08670311
ZINC000009699000
ZINC000009699003
Check stock
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