Vitas-M small molecule compound
2-({3-[(2-methyl-1H-benzimidazol-1-yl)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}methyl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK357925
SMILES O=C1N(Cc2nn3c(s2)nnc3Cn2c(C)nc3c2cccc3)C(=O)c2c1cccc2
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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 C21H15N7O2S MW 429.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N7O2S/c1-12-22-15-8-4-5-9-16(15)26(12)10-17-23-24-21-28(17)25-18(31-21)11-27-19(29)13-6-2-3-7-14(13)20(27)30/h2-9H,10-11H2,1H3InChIKey
MWYOZHSWGAMSKK-UHFFFAOYSA-NSynonyms
2((3((2methyl1Hbenzimidazol1yl)methyl)(124)triazolo(34b)(134)thiadiazol6yl)methyl)1Hisoindole13(2H)dione
2((3((2methylbenzimidazol1yl)methyl)(124)triazolo(34b)(134)thiadiazol6yl)methyl)isoindole13dione
CC1=NC2=CC=CC=C2N1CC3=NN=C4N3N=C(S4)CN5C(=O)C6=CC=CC=C6C5=O
InChI=1SC21H15N7O2Sc1122215845916(15)26(12)101723242128(17)2518(3121)112719(29)13623714(13)20(27)30h29H1011H21H3
MFCD11852098
ZINC000020102467
ZINC20102467
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