Vitas-M small molecule compound

N-(2-methoxyphenyl)-2,5-dinitro-1-benzothiophen-3-amine

Catalog ID
STK686018
SMILES COc1ccccc1Nc1c(sc2c1cc(cc2)[N+](=O)[O-])[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 C15H11N3O5S MW 345.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11N3O5S/c1-23-12-5-3-2-4-11(12)16-14-10-8-9(17(19)20)6-7-13(10)24-15(14)18(21)22/h2-8,16H,1H3
InChIKey
RRKQFDRRYVDQOO-UHFFFAOYSA-N
Synonyms

(25DINITROBENZO(B)THIOPHEN3YL)(2METHOXYPHENYL)AMINE
COC1=CC=CC=C1NC2=C(SC3=C2C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
COc1ccccc1Nc1c(sc2c1cc(cc2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC15H11N3O5Sc12312532411(12)16141089(17(19)20)6713(10)2415(14)18(21)22h2816H1H3
MFCD06014269
N(2methoxyphenyl)25dinitro1benzothiophen3amine
ZINC000004622789
ZINC04622789
ZINC4622789

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Available files

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