Vitas-M small molecule compound

1-benzyl-5-[(2-methoxy-5-nitrobenzyl)sulfanyl]-1H-tetrazole

Catalog ID
STK734091
SMILES COc1ccc(cc1CSc1nnnn1Cc1ccccc1)[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 C16H15N5O3S MW 357.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N5O3S/c1-24-15-8-7-14(21(22)23)9-13(15)11-25-16-17-18-19-20(16)10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3
InChIKey
JGJOQRDFBSMVMM-UHFFFAOYSA-N
Synonyms
346638-80-0
1BENZYL5((2METHOXY5NITROBENZYL)SULFANYL)1HTETRAAZOLE
1benzyl5((2methoxy5nitrobenzyl)sulfanyl)1Htetrazole
1BENZYL5((2METHOXY5NITROPHENYL)METHYLSULFANYL)TETRAZOLE
1BENZYL5(2METHOXY5NITROBENZYLSULFANYL)1HTETRAZOLE
346638800
COC1=C(C=C(C=C1)(N+)(=O)(O))CSC2=NN=NN2CC3=CC=CC=C3
COc1ccc(cc1CSc1nnnn1Cc1ccccc1)(N+)(=O)(O)
InChI=1SC16H15N5O3Sc124158714(21(22)23)913(15)11251617181920(16)10125324612h29H1011H21H3
MFCD01896083
ZINC000001067514
ZINC01067514
ZINC1067514

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Available files

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