Vitas-M small molecule compound

N-(2-methoxy-5-nitrophenyl)-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetamide

Catalog ID
STK226254
SMILES COc1ccc(cc1NC(=O)CSc1nnnn1c1ccccc1)[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 C16H14N6O4S MW 386.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N6O4S/c1-26-14-8-7-12(22(24)25)9-13(14)17-15(23)10-27-16-18-19-20-21(16)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,23)
InChIKey
CNIWCBSKOSTPJJ-UHFFFAOYSA-N
Synonyms
COC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)CSC2=NN=NN2C3=CC=CC=C3
COc1ccc(cc1NC(=O)CSc1nnnn1c1ccccc1)(N+)(=O)(O)
N(2methoxy5nitrophenyl)2((1phenyl1Htetrazol5yl)sulfanyl)acetamide
N(2METHOXY5NITROPHENYL)2(1PHENYLTETRAZOL5YL)SULFANYLACETAMIDE
Registry IDs
MFCD05997989
ZINC000002866238
ZINC02866238
ZINC2866238

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Available files

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