Vitas-M small molecule compound
2-[4-(1,1-dioxido-1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl benzoate
Catalog ID
STK742942
SMILES O=C(c1ccccc1)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 C20H21N3O4S MW 399.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4S/c24-20(16-6-2-1-3-7-16)27-15-14-22-10-12-23(13-11-22)19-17-8-4-5-9-18(17)28(25,26)21-19/h1-9H,10-15H2InChIKey
KSFCJBXQZYBTID-UHFFFAOYSA-NSynonyms
2(4(11dioxido12benzothiazol3yl)piperazin1yl)ethylbenzoate
2(4(11DIOXO12BENZOTHIAZOL3YL)PIPERAZIN1YL)ETHYLBENZOATE
C1CN(CCN1CCOC(=O)C2=CC=CC=C2)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC20H21N3O4Sc2420(166213716)27151422101223(131122)1917845918(17)28(2526)2119h19H1015H2
MFCD03067049
ZINC000019831633
ZINC19831633
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