Vitas-M small molecule compound

N-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-N-cyclopropyl-3-nitrobenzamide

Catalog ID
STK314950
SMILES O=C(N(c1nc(c(s1)C(=O)C)C)C1CC1)c1cccc(c1)[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 C16H15N3O4S MW 345.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O4S/c1-9-14(10(2)20)24-16(17-9)18(12-6-7-12)15(21)11-4-3-5-13(8-11)19(22)23/h3-5,8,12H,6-7H2,1-2H3
InChIKey
UPSQHULFRXLHCR-UHFFFAOYSA-N
Synonyms
881472-56-6
881472566
CC1=C(SC(=N1)N(C2CC2)C(=O)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)C
InChI=1SC16H15N3O4Sc1914(10(2)20)2416(179)18(126712)15(21)1143513(811)19(22)23h35812H67H212H3
MFCD08553762
N(5acetyl4methyl13thiazol2yl)Ncyclopropyl3nitrobenzamide
O=C(N(c1nc(c(s1)C(=O)C)C)C1CC1)c1cccc(c1)(N+)(=O)(O)
ZINC000013961243
ZINC13961243

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Available files

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