Vitas-M small molecule compound
1-({6-[(E)-2-(4-nitrophenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}methyl)-1H-benzimidazole
Catalog ID
STK506591
SMILES [O-][N+](=O)c1ccc(cc1)/C=C/c1nn2c(s1)nnc2Cn1cnc2c1cccc2
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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 C19H13N7O2S MW 403.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N7O2S/c27-26(28)14-8-5-13(6-9-14)7-10-18-23-25-17(21-22-19(25)29-18)11-24-12-20-15-3-1-2-4-16(15)24/h1-10,12H,11H2/b10-7+InChIKey
BUGFEYNFFKGJLN-JXMROGBWSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)C=Cc1nn2c(s1)nnc2Cn1cnc2c1cccc2
1((6((E)2(4nitrophenyl)ethenyl)(124)triazolo(34b)(134)thiadiazol3yl)methyl)1Hbenzimidazole
3(BENZIMIDAZOL1YLMETHYL)6((E)2(4NITROPHENYL)ETHENYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
C1=CC=C2C(=C1)N=CN2CC3=NN=C4N3N=C(S4)C=CC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC19H13N7O2Sc2726(28)148513(6914)71018232517(212219(25)2918)1124122015312416(15)24h11012H11H2b107+
MFCD06625765
ZINC000004754910
ZINC04754910
ZINC4754910
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