Vitas-M small molecule compound

2,6-dibromo-4-(morpholin-4-ylcarbonothioyl)phenyl 4-methoxybenzoate

Catalog ID
STK759524
SMILES COc1ccc(cc1)C(=O)Oc1c(Br)cc(cc1Br)C(=S)N1CCOCC1

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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 C19H17Br2NO4S MW 515.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17Br2NO4S/c1-24-14-4-2-12(3-5-14)19(23)26-17-15(20)10-13(11-16(17)21)18(27)22-6-8-25-9-7-22/h2-5,10-11H,6-9H2,1H3
InChIKey
CBMRJSCQWYIBJI-UHFFFAOYSA-N
Synonyms

(26DIBROMO4(MORPHOLINE4CARBOTHIOYL)PHENYL)4METHOXYBENZOATE
26dibromo4(morpholin4ylcarbonothioyl)phenyl4methoxybenzoate
COC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)C(=S)N3CCOCC3)Br
InChI=1SC19H17Br2NO4Sc124144212(3514)19(23)261715(20)1013(1116(17)21)18(27)2268259722h251011H69H21H3
MFCD01062341
ZINC000000714452
ZINC00714452
ZINC714452

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Available files

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