Vitas-M small molecule compound
3-[2-(5-chloro-2-methoxyphenyl)-2-oxoethyl]-6-(piperidin-1-ylsulfonyl)-1,3-benzoxazol-2(3H)-one
Catalog ID
STK983534
SMILES COc1ccc(cc1C(=O)Cn1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCCCC1)Cl
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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 C21H21ClN2O6S MW 464.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O6S/c1-29-19-8-5-14(22)11-16(19)18(25)13-24-17-7-6-15(12-20(17)30-21(24)26)31(27,28)23-9-3-2-4-10-23/h5-8,11-12H,2-4,9-10,13H2,1H3InChIKey
MQTONTBXEOJTIG-UHFFFAOYSA-NSynonyms
3(2(5chloro2methoxyphenyl)2oxoethyl)6(piperidin1ylsulfonyl)13benzoxazol2(3H)one
3(2(5chloro2methoxyphenyl)2oxoethyl)6piperidin1ylsulfonyl13benzoxazol2one
COC1=C(C=C(C=C1)Cl)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)OC2=O
InChI=1SC21H21ClN2O6Sc129198514(22)1116(19)18(25)1324177615(1220(17)3021(24)26)31(2728)2393241023h581112H2491013H21H3
MFCD08847561
ZINC000011689614
ZINC11689614
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