Vitas-M small molecule compound

3-bromo-N-[(4-chlorophenyl)carbamothioyl]-4-ethoxybenzamide

Catalog ID
STK052452
SMILES CCOc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(cc1)Cl

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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 C16H14BrClN2O2S MW 413.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrClN2O2S/c1-2-22-14-8-3-10(9-13(14)17)15(21)20-16(23)19-12-6-4-11(18)5-7-12/h3-9H,2H2,1H3,(H2,19,20,21,23)
InChIKey
MNVKSMPCHNVLJI-UHFFFAOYSA-N
Synonyms

3BROMON((4CHLOROPHENYL)CARBAMOTHIOYL)4ETHOXYBENZAMIDE
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)Cl)Br
CCOc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc(cc1)Cl
InChI=1SC16H14BrClN2O2Sc1222148310(913(14)17)15(21)2016(23)19126411(18)5712h39H2H21H3(H219202123)
MFCD02821223
STK052452
ZINC000001173998
ZINC01173998
ZINC1173998

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Available files

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