Vitas-M small molecule compound
4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 4-bromobenzoate
Catalog ID
STL286920
SMILES Brc1ccc(cc1)C(=O)Oc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)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 C21H15BrN2O4S MW 471.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrN2O4S/c1-24(20-18-4-2-3-5-19(18)29(26,27)23-20)16-10-12-17(13-11-16)28-21(25)14-6-8-15(22)9-7-14/h2-13H,1H3InChIKey
JIDIJZZPDJFUKC-UHFFFAOYSA-NSynonyms
(4((11DIOXO12BENZOTHIAZOL3YL)METHYLAMINO)PHENYL)4BROMOBENZOATE
4((11dioxido12benzothiazol3yl)(methyl)amino)phenyl4bromobenzoate
CN(C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)Br)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC21H15BrN2O4Sc124(2018423519(18)29(2627)2320)16101217(131116)2821(25)146815(22)9714h213H1H3
MFCD01235015
ZINC000003663927
ZINC3663927
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