Vitas-M small molecule compound
N-(4-chloro-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitrobenzamide
Catalog ID
STK259667
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1sc2c(n1)c(Cl)ccc2
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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 C16H12ClN3O4S MW 377.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN3O4S/c1-2-24-12-7-6-9(8-11(12)20(22)23)15(21)19-16-18-14-10(17)4-3-5-13(14)25-16/h3-8H,2H2,1H3,(H,18,19,21)InChIKey
SYZPPOZKSNCHIJ-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=CC=C3Cl)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)Nc1sc2c(n1)c(Cl)ccc2
InChI=1SC16H12ClN3O4Sc122412769(811(12)20(22)23)15(21)1916181410(17)43513(14)2516h38H2H21H3(H181921)
MFCD05796616
N(4chloro13benzothiazol2yl)4ethoxy3nitrobenzamide
ZINC000009426163
ZINC09426163
ZINC9426163
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