Vitas-M small molecule compound

ethyl 4-methyl-2-{[(3-nitrophenyl)carbonyl]amino}-1,3-thiazole-5-carboxylate

Catalog ID
STK226543
SMILES CCOC(=O)c1sc(nc1C)NC(=O)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 C14H13N3O5S MW 335.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N3O5S/c1-3-22-13(19)11-8(2)15-14(23-11)16-12(18)9-5-4-6-10(7-9)17(20)21/h4-7H,3H2,1-2H3,(H,15,16,18)
InChIKey
FQROQMBUYKXHMW-UHFFFAOYSA-N
Synonyms
313262-15-6
313262156
CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O))C
CCOC(=O)c1sc(nc1C)NC(=O)c1cccc(c1)(N+)(=O)(O)
ETHYL4METHYL2(((3NITROPHENYL)CARBONYL)AMINO)13THIAZOLE5CARBOXYLATE
ETHYL4METHYL2((3NITROBENZOYL)AMINO)13THIAZOLE5CARBOXYLATE
ETHYL4METHYL2((3NITROPHENYL)CARBONYLAMINO)13THIAZOLE5CARBOXYLATE
ETHYL4METHYL2(3NITROBENZAMIDO)THIAZOLE5CARBOXYLATE
InChI=1SC14H13N3O5Sc132213(19)118(2)1514(2311)1612(18)954610(79)17(20)21h47H3H212H3(H151618)
MFCD01021035
ZINC000000567814
ZINC00567814
ZINC567814

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Available files

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