Vitas-M small molecule compound
4-tert-butylcyclohexyl 5-({6-[chloro(difluoro)methoxy]-1,3-benzothiazol-2-yl}amino)-5-oxopentanoate
Catalog ID
STK499533
SMILES O=C(Nc1nc2c(s1)cc(cc2)OC(Cl)(F)F)CCCC(=O)OC1CCC(CC1)C(C)(C)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 C23H29ClF2N2O4S MW 503.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29ClF2N2O4S/c1-22(2,3)14-7-9-15(10-8-14)31-20(30)6-4-5-19(29)28-21-27-17-12-11-16(13-18(17)33-21)32-23(24,25)26/h11-15H,4-10H2,1-3H3,(H,27,28,29)InChIKey
FJGGWUGKSDQASB-UHFFFAOYSA-NSynonyms
(4tertbutylcyclohexyl)5((6(chloro(difluoro)methoxy)13benzothiazol2yl)amino)5oxopentanoate
4tertbutylcyclohexyl5((6(chloro(difluoro)methoxy)13benzothiazol2yl)amino)5oxopentanoate
CC(C)(C)C1CCC(CC1)OC(=O)CCCC(=O)NC2=NC3=C(S2)C=C(C=C3)OC(F)(F)Cl
InChI=1SC23H29ClF2N2O4Sc122(23)147915(10814)3120(30)64519(29)28212717121116(1318(17)3321)3223(2425)26h1115H410H213H3(H272829)
MFCD11855783
ZINC000032581161
ZINC32581161
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