Vitas-M small molecule compound

N-(6-chloro-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitrobenzamide

Catalog ID
STK281717
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1nc2c(s1)cc(cc2)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 C16H12ClN3O4S MW 377.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN3O4S/c1-2-24-13-6-3-9(7-12(13)20(22)23)15(21)19-16-18-11-5-4-10(17)8-14(11)25-16/h3-8H,2H2,1H3,(H,18,19,21)
InChIKey
HRUUOPNNKKCYJD-UHFFFAOYSA-N
Synonyms
637314-92-2
637314922
CCOC1=C(C=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)Nc1nc2c(s1)cc(cc2)Cl
InChI=1SC16H12ClN3O4Sc122413639(712(13)20(22)23)15(21)191618115410(17)814(11)2516h38H2H21H3(H181921)
MFCD04096001
N(6chloro13benzothiazol2yl)4ethoxy3nitrobenzamide
N(6chlorobenzo(d)thiazol2yl)4ethoxy3nitrobenzamide

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.