Vitas-M small molecule compound

3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl 2-bromobenzoate

Catalog ID
STL290951
SMILES O=C(c1ccccc1Br)Oc1cccc(c1)NC1=NS(=O)(=O)c2c1cccc2

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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 C20H13BrN2O4S MW 457.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrN2O4S/c21-17-10-3-1-8-15(17)20(24)27-14-7-5-6-13(12-14)22-19-16-9-2-4-11-18(16)28(25,26)23-19/h1-12H,(H,22,23)
InChIKey
HORRHCQBVAPNIT-UHFFFAOYSA-N
Synonyms

(3((11DIOXO12BENZOTHIAZOL3YL)AMINO)PHENYL)2BROMOBENZOATE
3((11dioxido12benzothiazol3yl)amino)phenyl2bromobenzoate
C1=CC=C2C(=C1)C(=NS2(=O)=O)NC3=CC(=CC=C3)OC(=O)C4=CC=CC=C4Br
InChI=1SC20H13BrN2O4Sc21171031815(17)20(24)271475613(1214)2219169241118(16)28(2526)2319h112H(H2223)
MFCD00763417
ZINC000001031720
ZINC1031720

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Available files

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