Vitas-M small molecule compound

2-bromo-N-({3-[(2-methylpropanoyl)amino]phenyl}carbamothioyl)benzamide

Catalog ID
STK259308
SMILES S=C(NC(=O)c1ccccc1Br)Nc1cccc(c1)NC(=O)C(C)C

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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 C18H18BrN3O2S MW 420.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN3O2S/c1-11(2)16(23)20-12-6-5-7-13(10-12)21-18(25)22-17(24)14-8-3-4-9-15(14)19/h3-11H,1-2H3,(H,20,23)(H2,21,22,24,25)
InChIKey
DIEQXQZZAONFQB-UHFFFAOYSA-N
Synonyms

2bromoN((3((2methylpropanoyl)amino)phenyl)carbamothioyl)benzamide
2BROMON((3(2METHYLPROPANOYLAMINO)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CC(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC=C2Br
InChI=1SC18H18BrN3O2Sc111(2)16(23)201265713(1012)2118(25)2217(24)14834915(14)19h311H12H3(H2023)(H221222425)
MFCD03260776
ZINC000001148630
ZINC01148630
ZINC1148630

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Available files

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