Vitas-M small molecule compound

4-nitro-2-[2-(phenylsulfanyl)phenyl]-1H-isoindole-1,3(2H)-dione

Catalog ID
STK315013
SMILES O=C1c2cccc(c2C(=O)N1c1ccccc1Sc1ccccc1)[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 C20H12N2O4S MW 376.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12N2O4S/c23-19-14-9-6-11-16(22(25)26)18(14)20(24)21(19)15-10-4-5-12-17(15)27-13-7-2-1-3-8-13/h1-12H
InChIKey
CJNBVFYTTSUXCE-UHFFFAOYSA-N
Synonyms
881475-64-5
4nitro2(2(phenylsulfanyl)phenyl)1Hisoindole13(2H)dione
4nitro2(2phenylsulfanylphenyl)isoindole13dione
4NITRO2(2PHENYLTHIOPHENYL)BENZO(C)AZOLINE13DIONE
881475645
C1=CC=C(C=C1)SC2=CC=CC=C2N3C(=O)C4=C(C3=O)C(=CC=C4)(N+)(=O)(O)
InChI=1SC20H12N2O4Sc231914961116(22(25)26)18(14)20(24)21(19)1510451217(15)27137213813h112H
MFCD08554023
O=C1c2cccc(c2C(=O)N1c1ccccc1Sc1ccccc1)(N+)(=O)(O)
ZINC000013961295
ZINC13961295

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Available files

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