Vitas-M small molecule compound

(3-chloro-6-nitro-1-benzothiophen-2-yl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone

Catalog ID
STK508669
SMILES Cc1nn(c(c1)C)C(=O)c1sc2c(c1Cl)ccc(c2)[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 C14H10ClN3O3S MW 335.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10ClN3O3S/c1-7-5-8(2)17(16-7)14(19)13-12(15)10-4-3-9(18(20)21)6-11(10)22-13/h3-6H,1-2H3
InChIKey
QTMKIWPNSQSGBK-UHFFFAOYSA-N
Synonyms
312309-87-8
(3chloro6nitro1benzothiophen2yl)(35dimethyl1Hpyrazol1yl)methanone
(3CHLORO6NITRO1BENZOTHIOPHEN2YL)(35DIMETHYLPYRAZOL1YL)METHANONE
(3chloro6nitrobenzo(b)thiophen2yl)(35dimethyl1Hpyrazol1yl)methanone
(3CHLORO6NITROBENZO(B)THIOPHEN2YL)(35DIMETHYLPYRAZOL1YL)METHANONE
312309878
CC1=CC(=NN1C(=O)C2=C(C3=C(S2)C=C(C=C3)(N+)(=O)(O))Cl)C
Cc1nn(c(c1)C)C(=O)c1sc2c(c1Cl)ccc(c2)(N+)(=O)(O)
InChI=1SC14H10ClN3O3Sc1758(2)17(167)14(19)1312(15)10439(18(20)21)611(10)2213h36H12H3
MFCD01796001
ZINC000000261013
ZINC00261013
ZINC261013

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Available files

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