Vitas-M small molecule compound

1-methyl-5-{[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl}-1H-tetrazole

Catalog ID
STK380913
SMILES [O-][N+](=O)c1cc(ccc1Sc1nnnn1C)C(F)(F)F

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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 C9H6F3N5O2S MW 305.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H6F3N5O2S/c1-16-8(13-14-15-16)20-7-3-2-5(9(10,11)12)4-6(7)17(18)19/h2-4H,1H3
InChIKey
NLUCAVHXSOXUKA-UHFFFAOYSA-N
Synonyms
332143-62-1
(O)(N+)(=O)c1cc(ccc1Sc1nnnn1C)C(F)(F)F
1methyl5((2nitro4(trifluoromethyl)phenyl)sulfanyl)1Htetrazole
1methyl5((2nitro4(trifluoromethyl)phenyl)thio)1Htetrazole
1METHYL5(2NITRO4(TRIFLUOROMETHYL)PHENYL)SULFANYLTETRAZOLE
1METHYL5(2NITRO4TRIFLUOROMETHYLPHENYLSULFANYL)1HTETRAZOLE
332143621
CN1C(=NN=N1)SC2=C(C=C(C=C2)C(F)(F)F)(N+)(=O)(O)
InChI=1SC9H6F3N5O2Sc1168(13141516)207325(9(1011)12)46(7)17(18)19h24H1H3
MFCD00754660
ZINC000002327385
ZINC02327385
ZINC2327385

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Available files

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