Vitas-M small molecule compound
3-[2-(2-methoxy-5-methylphenyl)-2-oxoethyl]-6-(morpholin-4-ylsulfonyl)-1,3-benzoxazol-2(3H)-one
Catalog ID
STK983533
SMILES COc1ccc(cc1C(=O)Cn1c(=O)oc2c1ccc(c2)S(=O)(=O)N1CCOCC1)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 C21H22N2O7S MW 446.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O7S/c1-14-3-6-19(28-2)16(11-14)18(24)13-23-17-5-4-15(12-20(17)30-21(23)25)31(26,27)22-7-9-29-10-8-22/h3-6,11-12H,7-10,13H2,1-2H3InChIKey
URQUDNVUPWSJFY-UHFFFAOYSA-NSynonyms
3(2(2methoxy5methylphenyl)2oxoethyl)6(morpholin4ylsulfonyl)13benzoxazol2(3H)one
3(2(2methoxy5methylphenyl)2oxoethyl)6morpholin4ylsulfonyl13benzoxazol2one
CC1=CC(=C(C=C1)OC)C(=O)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)OC2=O
InChI=1SC21H22N2O7Sc1143619(282)16(1114)18(24)1323175415(1220(17)3021(23)25)31(2627)22792910822h361112H71013H212H3
MFCD08847600
ZINC000011689613
ZINC11689613
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