Vitas-M small molecule compound
(2Z)-2-[(3-methylthiophen-2-yl)methylidene]-8-(tetrahydrofuran-2-ylmethyl)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
Catalog ID
STK626136
SMILES O=C1/C(=C/c2sccc2C)/Oc2c1ccc1c2CN(CO1)CC1CCCO1
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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 C21H21NO4S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4S/c1-13-6-8-27-19(13)9-18-20(23)15-4-5-17-16(21(15)26-18)11-22(12-25-17)10-14-3-2-7-24-14/h4-6,8-9,14H,2-3,7,10-12H2,1H3/b18-9-InChIKey
NNDYVVDLNOEBNY-NVMNQCDNSA-NSynonyms
951977-00-7(2Z)2((3methylthiophen2yl)methylidene)8(oxolan2ylmethyl)79dihydrofuro(23f)(13)benzoxazin3one
(2Z)2((3methylthiophen2yl)methylidene)8(tetrahydrofuran2ylmethyl)89dihydro7Hfuro(23f)(13)benzoxazin3(2H)one
(Z)2((3methylthiophen2yl)methylene)8((tetrahydrofuran2yl)methyl)89dihydro2Hbenzofuro(76e)(13)oxazin3(7H)one
951977007
CC1=C(SC=C1)C=C2C(=O)C3=C(O2)C4=C(C=C3)OCN(C4)CC5CCCO5
InChI=1SC21H21NO4Sc113682719(13)91820(23)15451716(21(15)2618)1122(122517)10143272414h468914H2371012H21H3b189
MFCD09854523
O=C1C(=Cc2sccc2C)Oc2c1ccc1c2CN(CO1)CC1CCCO1
ZINC000013718957
ZINC000013718962
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