Vitas-M small molecule compound
2-[4-(1,1-dioxido-1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl 2-methylbenzoate
Catalog ID
STK181104
SMILES O=C(c1ccccc1C)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 C21H23N3O4S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4S/c1-16-6-2-3-7-17(16)21(25)28-15-14-23-10-12-24(13-11-23)20-18-8-4-5-9-19(18)29(26,27)22-20/h2-9H,10-15H2,1H3InChIKey
CYWKUKDZJFPXPC-UHFFFAOYSA-NSynonyms
2(4(11DIOXIDO12BENZOTHIAZOL3YL)PIPERAZIN1YL)ETHYL2METHYLBENZOATE
2(4(11DIOXO12BENZOTHIAZOL3YL)PIPERAZIN1YL)ETHYL2METHYLBENZOATE
CC1=CC=CC=C1C(=O)OCCN2CCN(CC2)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC21H23N3O4Sc116623717(16)21(25)28151423101224(131123)2018845919(18)29(2627)2220h29H1015H21H3
MFCD04276518
ZINC000019869063
ZINC19869063
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