Vitas-M small molecule compound
N-[5-(4-methoxybenzyl)-1,3,4-thiadiazol-2-yl]-2-methyl-3,5-dinitrobenzamide
Catalog ID
STK119827
SMILES COc1ccc(cc1)Cc1nnc(s1)NC(=O)c1cc(cc(c1C)[N+](=O)[O-])[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 C18H15N5O6S MW 429.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N5O6S/c1-10-14(8-12(22(25)26)9-15(10)23(27)28)17(24)19-18-21-20-16(30-18)7-11-3-5-13(29-2)6-4-11/h3-6,8-9H,7H2,1-2H3,(H,19,21,24)InChIKey
CCKIOJODJNTUDQ-UHFFFAOYSA-NSynonyms
636994-42-8636994428
CC1=C(C=C(C=C1C(=O)NC2=NN=C(S2)CC3=CC=C(C=C3)OC)(N+)(=O)(O))(N+)(=O)(O)
COc1ccc(cc1)Cc1nnc(s1)NC(=O)c1cc(cc(c1C)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC18H15N5O6Sc11014(812(22(25)26)915(10)23(27)28)17(24)1918212016(3018)7113513(292)6411h3689H7H212H3(H192124)
MFCD03352026
N(5((4METHOXYPHENYL)METHYL)(134THIADIAZOL2YL))(2METHYL35DINITROPHENYL)CARBOXAMIDE
N(5((4METHOXYPHENYL)METHYL)134THIADIAZOL2YL)2METHYL35DINITROBENZAMIDE
N(5(4METHOXYBENZYL)134THIADIAZOL2YL)2METHYL35DINITROBENZAMIDE
ZINC000009805611
ZINC09805611
ZINC9805611
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