Vitas-M small molecule compound

5-[(4-methoxy-3-nitrobenzyl)sulfanyl]-1-(naphthalen-1-yl)-1H-tetrazole

Catalog ID
STK126265
SMILES COc1ccc(cc1[N+](=O)[O-])CSc1nnnn1c1cccc2c1cccc2

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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 C19H15N5O3S MW 393.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O3S/c1-27-18-10-9-13(11-17(18)24(25)26)12-28-19-20-21-22-23(19)16-8-4-6-14-5-2-3-7-15(14)16/h2-11H,12H2,1H3
InChIKey
USGNYRHBEHSNJD-UHFFFAOYSA-N
Synonyms
332129-78-9
332129789
5((4METHOXY3NITROBENZYL)SULFANYL)1(1NAPHTHYL)1HTETRAAZOLE
5((4METHOXY3NITROBENZYL)SULFANYL)1(NAPHTHALEN1YL)1HTETRAZOLE
5((4methoxy3nitrobenzyl)thio)1(naphthalen1yl)1Htetrazole
5((4METHOXY3NITROPHENYL)METHYLSULFANYL)1NAPHTHALEN1YLTETRAZOLE
5(4METHOXY3NITROBENZYLSULFANYL)1NAPHTHALEN1YL1HTETRAZOLE
COC1=C(C=C(C=C1)CSC2=NN=NN2C3=CC=CC4=CC=CC=C43)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))CSc1nnnn1c1cccc2c1cccc2
InChI=1SC19H15N5O3Sc1271810913(1117(18)24(25)26)12281920212223(19)1684614523715(14)16h211H12H21H3
MFCD00716685
ZINC000000852603
ZINC00852603
ZINC852603

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Available files

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