Vitas-M small molecule compound
N-{3-[1-(3-chloro-4-methoxyphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-1,2,4-thiadiazol-5-yl}-3,4-dimethylbenzamide
Catalog ID
STL192960
SMILES COc1ccc(cc1Cl)n1nnc(c1C)c1nsc(n1)NC(=O)c1ccc(c(c1)C)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 C21H19ClN6O2S MW 454.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN6O2S/c1-11-5-6-14(9-12(11)2)20(29)24-21-23-19(26-31-21)18-13(3)28(27-25-18)15-7-8-17(30-4)16(22)10-15/h5-10H,1-4H3,(H,23,24,26,29)InChIKey
UZJZFBWKNJMCFM-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C(=O)NC2=NC(=NS2)C3=C(N(N=N3)C4=CC(=C(C=C4)OC)Cl)C)C
InChI=1SC21H19ClN6O2Sc1115614(912(11)2)20(29)24212319(263121)1813(3)28(272518)157817(304)16(22)1015h510H14H3(H23242629)
MFCD14983311
N(3(1(3chloro4methoxyphenyl)5methyl1H123triazol4yl)124thiadiazol5yl)34dimethylbenzamide
N(3(1(3chloro4methoxyphenyl)5methyltriazol4yl)124thiadiazol5yl)34dimethylbenzamide
ZINC000008831157
ZINC8831157
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