Vitas-M small molecule compound
(2Z)-8-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(thiophen-2-ylmethylidene)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Catalog ID
STK622788
SMILES O=C1/C(=C/c2cccs2)/Oc2c1ccc1c2CN(CO1)c1ccc2c(c1)OCCO2
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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 C23H17NO5S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17NO5S/c25-22-16-4-6-18-17(23(16)29-21(22)11-15-2-1-9-30-15)12-24(13-28-18)14-3-5-19-20(10-14)27-8-7-26-19/h1-6,9-11H,7-8,12-13H2/b21-11-InChIKey
NTDCDFRBBZWTAR-NHDPSOOVSA-NSynonyms
951933-55-4(2Z)8(23dihydro14benzodioxin6yl)2(thiophen2ylmethylidene)79dihydrofuro(23f)(13)benzoxazin3one
(2Z)8(23dihydro14benzodioxin6yl)2(thiophen2ylmethylidene)89dihydro7Hfuro(23f)(13)benzoxazin3(2H)one
(Z)8(23dihydrobenzo(b)(14)dioxin6yl)2(thiophen2ylmethylene)89dihydro2Hbenzofuro(76e)(13)oxazin3(7H)one
951933554
C1COC2=C(O1)C=CC(=C2)N3CC4=C(C=CC5=C4OC(=CC6=CC=CS6)C5=O)OC3
InChI=1SC23H17NO5Sc252216461817(23(16)2921(22)11152193015)1224(132818)14351920(1014)27872619h16911H781213H2b2111
MFCD09850583
O=C1C(=Cc2cccs2)Oc2c1ccc1c2CN(CO1)c1ccc2c(c1)OCCO2
ZINC000013687938
ZINC13687938
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