Vitas-M small molecule compound
4-chloro-N-[5-(2-methoxybenzyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide
Catalog ID
STK260486
SMILES COc1ccccc1Cc1nnc(s1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C17H13ClN4O4S MW 404.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4O4S/c1-26-14-5-3-2-4-10(14)9-15-20-21-17(27-15)19-16(23)11-6-7-12(18)13(8-11)22(24)25/h2-8H,9H2,1H3,(H,19,21,23)InChIKey
PKLNAHPXSRMDTM-UHFFFAOYSA-NSynonyms
893237-66-6(4CHLORO3NITROPHENYL)N(5((2METHOXYPHENYL)METHYL)(134THIADIAZOL2YL))CARBOXAMIDE
4chloroN(5((2methoxyphenyl)methyl)134thiadiazol2yl)3nitrobenzamide
4chloroN(5(2methoxybenzyl)134thiadiazol2yl)3nitrobenzamide
893237666
COC1=CC=CC=C1CC2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)Cl)(N+)(=O)(O)
COc1ccccc1Cc1nnc(s1)NC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC17H13ClN4O4Sc12614532410(14)915202117(2715)1916(23)116712(18)13(811)22(24)25h28H9H21H3(H192123)
MFCD07150452
ZINC000009426456
ZINC09426456
ZINC9426456
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