Vitas-M small molecule compound

3-methyl-4-nitro-N-(4H-1,2,4-triazol-3-yl)benzamide

Catalog ID
STK057753
SMILES O=C(c1ccc(c(c1)C)[N+](=O)[O-])Nc1nnc[nH]1

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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 C10H9N5O3 MW 247.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9N5O3/c1-6-4-7(2-3-8(6)15(17)18)9(16)13-10-11-5-12-14-10/h2-5H,1H3,(H2,11,12,13,14,16)
InChIKey
WHQDNDFEPCHKOL-UHFFFAOYSA-N
Synonyms
313981-67-8
313981678
3METHYL4NITRON(1H124TRIAZOL5YL)BENZAMIDE
3METHYL4NITRON(4H124TRIAZOL3YL)BENZAMIDE
3METHYL4NITRON4H124TRIAZOL3YLBENZAMIDE
CC1=C(C=CC(=C1)C(=O)NC2=NC=NN2)(N+)(=O)(O)
InChI=1SC10H9N5O3c1647(238(6)15(17)18)9(16)1310115121410h25H1H3(H21112131416)
MFCD03142898
O=C(c1ccc(c(c1)C)(N+)(=O)(O))Nc1nnc(nH)1
STK057753
ZINC000018115479
ZINC18115479

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Available files

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