Vitas-M small molecule compound
2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl 4-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-4-oxobutanoate
Catalog ID
STK265986
SMILES CCOc1ccc2c(c1)sc(n2)NC(=O)CCC(=O)OCC(=O)Nc1ccc(c(c1)Cl)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 C22H22ClN3O5S MW 475.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O5S/c1-3-30-15-6-7-17-18(11-15)32-22(25-17)26-19(27)8-9-21(29)31-12-20(28)24-14-5-4-13(2)16(23)10-14/h4-7,10-11H,3,8-9,12H2,1-2H3,(H,24,28)(H,25,26,27)InChIKey
CYBZAMNABORDPK-UHFFFAOYSA-NSynonyms
(2(3chloro4methylanilino)2oxoethyl)4((6ethoxy13benzothiazol2yl)amino)4oxobutanoate
2((3chloro4methylphenyl)amino)2oxoethyl4((6ethoxy13benzothiazol2yl)amino)4oxobutanoate
CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC(=O)OCC(=O)NC3=CC(=C(C=C3)C)Cl
InChI=1SC22H22ClN3O5Sc133015671718(1115)3222(2517)2619(27)8921(29)311220(28)24145413(2)16(23)1014h471011H38912H212H3(H2428)(H252627)
MFCD06756152
ZINC000009581314
ZINC09581314
ZINC9581314
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