Vitas-M small molecule compound

3-chloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]-4-nitroaniline

Catalog ID
STK366422
SMILES Cc1ccc2c(c1)nnn2CNc1ccc(c(c1)Cl)[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 C14H12ClN5O2 MW 317.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12ClN5O2/c1-9-2-4-14-12(6-9)17-18-19(14)8-16-10-3-5-13(20(21)22)11(15)7-10/h2-7,16H,8H2,1H3
InChIKey
VBHISMVCZNVQNY-UHFFFAOYSA-N
Synonyms

(3CHLORO4NITROPHENYL)((5METHYLBENZOTRIAZOLYL)METHYL)AMINE
3chloroN((5methyl1Hbenzotriazol1yl)methyl)4nitroaniline
3CHLORON((5METHYLBENZOTRIAZOL1YL)METHYL)4NITROANILINE
CC1=CC2=C(C=C1)N(N=N2)CNC3=CC(=C(C=C3)(N+)(=O)(O))Cl
Cc1ccc2c(c1)nnn2CNc1ccc(c(c1)Cl)(N+)(=O)(O)
InChI=1SC14H12ClN5O2c19241412(69)171819(14)816103513(20(21)22)11(15)710h2716H8H21H3
MFCD00406846
ZINC000004015198
ZINC04015198
ZINC4015198

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Available files

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