Vitas-M small molecule compound

3-methyl-2-nitro-4,5-diphenylthiophene

Catalog ID
STK791083
SMILES [O-][N+](=O)c1sc(c(c1C)c1ccccc1)c1ccccc1

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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 C17H13NO2S MW 295.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13NO2S/c1-12-15(13-8-4-2-5-9-13)16(21-17(12)18(19)20)14-10-6-3-7-11-14/h2-11H,1H3
InChIKey
BNVAUSXYLJXRGW-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1sc(c(c1C)c1ccccc1)c1ccccc1
3METHYL2NITRO45DIPHENYLTHIOPHENE
CC1=C(SC(=C1C2=CC=CC=C2)C3=CC=CC=C3)(N+)(=O)(O)
InChI=1SC17H13NO2Sc11215(138425913)16(2117(12)18(19)20)14106371114h211H1H3
MFCD00688356
ZINC000003064506
ZINC03064506
ZINC3064506

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Available files

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