Vitas-M small molecule compound

ethyl 5-methyl-2-{[(2-nitrophenyl)acetyl]amino}thiophene-3-carboxylate

Catalog ID
STK429577
SMILES CCOC(=O)c1cc(sc1NC(=O)Cc1ccccc1[N+](=O)[O-])C

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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 C16H16N2O5S MW 348.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O5S/c1-3-23-16(20)12-8-10(2)24-15(12)17-14(19)9-11-6-4-5-7-13(11)18(21)22/h4-8H,3,9H2,1-2H3,(H,17,19)
InChIKey
MZZWSGOHSGMEPV-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1)C)NC(=O)CC2=CC=CC=C2(N+)(=O)(O)
CCOC(=O)c1cc(sc1NC(=O)Cc1ccccc1(N+)(=O)(O))C
ethyl5methyl2(((2nitrophenyl)acetyl)amino)thiophene3carboxylate
ETHYL5METHYL2((2(2NITROPHENYL)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5METHYL2(2(2NITROPHENYL)ACETYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC16H16N2O5Sc132316(20)12810(2)2415(12)1714(19)911645713(11)18(21)22h48H39H212H3(H1719)
MFCD03234248
ZINC000002730403
ZINC02730403
ZINC2730403

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Available files

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