Vitas-M small molecule compound

1-{4-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-3-nitrophenyl}ethanone

Catalog ID
STL069871
SMILES [O-][N+](=O)c1cc(ccc1Sc1nnnn1C)C(=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 C10H9N5O3S MW 279.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9N5O3S/c1-6(16)7-3-4-9(8(5-7)15(17)18)19-10-11-12-13-14(10)2/h3-5H,1-2H3
InChIKey
ILBTUJAYEYKEKY-UHFFFAOYSA-N
Synonyms
332860-94-3
(O)(N+)(=O)c1cc(ccc1Sc1nnnn1C)C(=O)C
1(4((1methyl1Htetrazol5yl)sulfanyl)3nitrophenyl)ethanone
1(4((1methyl1Htetrazol5yl)thio)3nitrophenyl)ethanone
1(4(1METHYL1HTETRAZOL5YLSULFANYL)3NITROPHENYL)ETHANONE
1(4(1METHYLTETRAZOL5YL)SULFANYL3NITROPHENYL)ETHANONE
332860943
CC(=O)C1=CC(=C(C=C1)SC2=NN=NN2C)(N+)(=O)(O)
InChI=1SC10H9N5O3Sc16(16)7349(8(57)15(17)18)191011121314(10)2h35H12H3
MFCD01204577
ZINC000000337922
ZINC00337922
ZINC337922

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Available files

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