Vitas-M small molecule compound
ethyl 4-{[9-(1,1-dioxidotetrahydrothiophen-3-yl)-2-methyl-4-oxo-9,10-dihydro-4H,8H-chromeno[8,7-e][1,3]oxazin-3-yl]oxy}benzoate
Catalog ID
STK643363
SMILES CCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc1c2CN(CO1)C1CCS(=O)(=O)C1
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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 C25H25NO8S MW 499.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO8S/c1-3-31-25(28)16-4-6-18(7-5-16)34-23-15(2)33-24-19(22(23)27)8-9-21-20(24)12-26(14-32-21)17-10-11-35(29,30)13-17/h4-9,17H,3,10-14H2,1-2H3InChIKey
NLXRHXDDYXFDDP-UHFFFAOYSA-NSynonyms
951944-37-9951944379
CCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC4=C3CN(CO4)C5CCS(=O)(=O)C5)C
ethyl4((9(11dioxidotetrahydrothiophen3yl)2methyl4oxo48910tetrahydrochromeno(87e)(13)oxazin3yl)oxy)benzoate
ethyl4((9(11dioxidotetrahydrothiophen3yl)2methyl4oxo910dihydro4H8Hchromeno(87e)(13)oxazin3yl)oxy)benzoate
ethyl4((9(11dioxothiolan3yl)2methyl4oxo810dihydropyrano(23f)(13)benzoxazin3yl)oxy)benzoate
ETHYL4(9(11DIOXOTHIOLAN3YL)2METHYL4OXO8H10HCHROMENO(87E)13OXAZAPERHYDROIN3YLOXY)BENZOATE
InChI=1SC25H25NO8Sc133125(28)164618(7516)342315(2)332419(22(23)27)892120(24)1226(143221)17101135(2930)1317h4917H31014H212H3
MFCD09851200
ZINC000013689671
ZINC000013689672
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