Vitas-M small molecule compound
3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-bromobenzoate
Catalog ID
STK134171
SMILES Brc1ccc(cc1)C(=O)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/c21-14-10-8-13(9-11-14)20(24)27-16-5-3-4-15(12-16)22-19-17-6-1-2-7-18(17)28(25,26)23-19/h1-12H,(H,22,23)InChIKey
AJODCRJHUMCQPK-UHFFFAOYSA-NSynonyms
(3((11dioxo12benzothiazol3yl)amino)phenyl)4bromobenzoate
3((11DIOXIDO12BENZOTHIAZOL3YL)AMINO)PHENYL4BROMOBENZOATE
C1=CC=C2C(=C1)C(=NS2(=O)=O)NC3=CC(=CC=C3)OC(=O)C4=CC=C(C=C4)Br
InChI=1SC20H13BrN2O4Sc211410813(91114)20(24)271653415(1216)221917612718(17)28(2526)2319h112H(H2223)
MFCD01204227
ZINC000001059680
ZINC01059680
ZINC1059680
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