Vitas-M small molecule compound
4-[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methoxybenzyl)amino]phenyl 2,4-dichlorobenzoate
Catalog ID
STK180111
SMILES COc1ccc(cc1)CN(C1=NS(=O)(=O)c2c1cccc2)c1ccc(cc1)OC(=O)c1ccc(cc1Cl)Cl
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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 C28H20Cl2N2O5S MW 567.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20Cl2N2O5S/c1-36-21-11-6-18(7-12-21)17-32(27-24-4-2-3-5-26(24)38(34,35)31-27)20-9-13-22(14-10-20)37-28(33)23-15-8-19(29)16-25(23)30/h2-16H,17H2,1H3InChIKey
ZQFRTYCYXNMWJF-UHFFFAOYSA-NSynonyms
(4((11DIOXO12BENZOTHIAZOL3YL)((4METHOXYPHENYL)METHYL)AMINO)PHENYL)24DICHLOROBENZOATE
4((11DIOXIDO12BENZISOTHIAZOL3YL)(4METHOXYBENZYL)AMINO)PHENYL24DICHLOROBENZOATE
4((11DIOXIDO12BENZOTHIAZOL3YL)(4METHOXYBENZYL)AMINO)PHENYL24DICHLOROBENZOATE
COC1=CC=C(C=C1)CN(C2=CC=C(C=C2)OC(=O)C3=C(C=C(C=C3)Cl)Cl)C4=NS(=O)(=O)C5=CC=CC=C54
InChI=1SC28H20Cl2N2O5Sc1362111618(71221)1732(2724423526(24)38(3435)3127)2091322(141020)3728(33)2315819(29)1625(23)30h216H17H21H3
MFCD04091346
ZINC000002170772
ZINC02170772
ZINC2170772
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