Vitas-M small molecule compound
2-[4-(1,1-dioxido-1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl (2,4-dichlorophenoxy)acetate
Catalog ID
STK181110
SMILES O=C(COc1ccc(cc1Cl)Cl)OCCN1CCN(CC1)C1=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 C21H21Cl2N3O5S MW 498.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21Cl2N3O5S/c22-15-5-6-18(17(23)13-15)31-14-20(27)30-12-11-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)32(28,29)24-21/h1-6,13H,7-12,14H2InChIKey
CWHACSZCDNKLEH-UHFFFAOYSA-NSynonyms
2(4(11DIOXIDO12BENZOTHIAZOL3YL)PIPERAZIN1YL)ETHYL(24DICHLOROPHENOXY)ACETATE
2(4(11DIOXO12BENZOTHIAZOL3YL)PIPERAZIN1YL)ETHYL2(24DICHLOROPHENOXY)ACETATE
C1CN(CCN1CCOC(=O)COC2=C(C=C(C=C2)Cl)Cl)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC21H21Cl2N3O5Sc22155618(17(23)1315)311420(27)301211257926(10825)2116312419(16)32(2829)2421h1613H71214H2
MFCD05150161
ZINC000019869066
ZINC19869066
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