Vitas-M small molecule compound
4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl benzoate
Catalog ID
STL290954
SMILES O=C(c1ccccc1)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 C21H16N2O4S MW 392.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O4S/c1-23(20-18-9-5-6-10-19(18)28(25,26)22-20)16-11-13-17(14-12-16)27-21(24)15-7-3-2-4-8-15/h2-14H,1H3InChIKey
DFOLGYLYIGLVRR-UHFFFAOYSA-NSynonyms
(4((11DIOXO12BENZOTHIAZOL3YL)METHYLAMINO)PHENYL)BENZOATE
4((11dioxido12benzothiazol3yl)(methyl)amino)phenylbenzoate
BENZOICACID4((11DIOXO1H1LAMBDA6BENZO(D)ISOTHIAZOL3YL)METHYLAMINO)PHENYLESTER
CN(C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC21H16N2O4Sc123(20189561019(18)28(2526)2220)16111317(141216)2721(24)157324815h214H1H3
MFCD01230317
ZINC000000848943
ZINC00848943
ZINC848943
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