Vitas-M small molecule compound

N-[4-(4-methylphenyl)-5-phenyl-1,3-thiazol-2-yl]-2-nitrobenzamide

Catalog ID
STK120375
SMILES Cc1ccc(cc1)c1nc(sc1c1ccccc1)NC(=O)c1ccccc1[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 C23H17N3O3S MW 415.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O3S/c1-15-11-13-16(14-12-15)20-21(17-7-3-2-4-8-17)30-23(24-20)25-22(27)18-9-5-6-10-19(18)26(28)29/h2-14H,1H3,(H,24,25,27)
InChIKey
NGWUWKOSMHFHEC-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC=CC=C3(N+)(=O)(O))C4=CC=CC=C4
Cc1ccc(cc1)c1nc(sc1c1ccccc1)NC(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC23H17N3O3Sc115111316(141215)2021(177324817)3023(2420)2522(27)189561019(18)26(28)29h214H1H3(H242527)
MFCD01422511
N(4(4METHYLPHENYL)5PHENYL13THIAZOL2YL)2NITROBENZAMIDE
ZINC000001196673
ZINC01196673
ZINC1196673

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Available files

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