Vitas-M small molecule compound

3-nitro-4-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]benzaldehyde

Catalog ID
STL285271
SMILES O=Cc1ccc(c(c1)[N+](=O)[O-])Sc1nnnn1c1ccccc1

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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 C14H9N5O3S MW 327.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9N5O3S/c20-9-10-6-7-13(12(8-10)19(21)22)23-14-15-16-17-18(14)11-4-2-1-3-5-11/h1-9H
InChIKey
JPVZUDPUNRAWAJ-UHFFFAOYSA-N
Synonyms
461439-08-7
3nitro4((1phenyl1Htetrazol5yl)sulfanyl)benzaldehyde
3NITRO4(1PHENYLTETRAZOL5YL)SULFANYLBENZALDEHYDE
461439087
C1=CC=C(C=C1)N2C(=NN=N2)SC3=C(C=C(C=C3)C=O)(N+)(=O)(O)
InChI=1SC14H9N5O3Sc209106713(12(810)19(21)22)231415161718(14)114213511h19H
MFCD03251176
O=Cc1ccc(c(c1)(N+)(=O)(O))Sc1nnnn1c1ccccc1
ZINC000002993443
ZINC02993443
ZINC2993443

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Available files

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