Vitas-M small molecule compound
2-chloro-N-(4-{5-[(2-chloro-6-nitrobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}phenyl)benzamide
Catalog ID
STK134228
SMILES Cn1c(nnc1c1ccc(cc1)NC(=O)c1ccccc1Cl)SCc1c(Cl)cccc1[N+](=O)[O-]
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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 C23H17Cl2N5O3S MW 514.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17Cl2N5O3S/c1-29-21(27-28-23(29)34-13-17-19(25)7-4-8-20(17)30(32)33)14-9-11-15(12-10-14)26-22(31)16-5-2-3-6-18(16)24/h2-12H,13H2,1H3,(H,26,31)InChIKey
OHRZQXROASGHQU-UHFFFAOYSA-NSynonyms
2CHLORON(4(5((2CHLORO6NITROBENZYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PHENYL)BENZAMIDE
2CHLORON(4(5((2CHLORO6NITROPHENYL)METHYLSULFANYL)4METHYL124TRIAZOL3YL)PHENYL)BENZAMIDE
CN1C(=NN=C1SCC2=C(C=CC=C2Cl)(N+)(=O)(O))C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4Cl
Cn1c(nnc1c1ccc(cc1)NC(=O)c1ccccc1Cl)SCc1c(Cl)cccc1(N+)(=O)(O)
InChI=1SC23H17Cl2N5O3Sc12921(272823(29)34131719(25)74820(17)30(32)33)1491115(121014)2622(31)16523618(16)24h212H13H21H3(H2631)
MFCD04208904
ZINC000002997810
ZINC02997810
ZINC2997810
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