Vitas-M small molecule compound
(7Z)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-9-methyl-7-(thiophen-2-ylmethylidene)-3,4-dihydro-2H-furo[3,2-g][1,3]benzoxazin-6(7H)-one
Catalog ID
STK643775
SMILES O=C1/C(=C/c2cccs2)/Oc2c1cc1CN(COc1c2C)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 C20H19NO5S2 MW 417.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO5S2/c1-12-19-13(9-21(11-25-19)14-4-6-28(23,24)10-14)7-16-18(22)17(26-20(12)16)8-15-3-2-5-27-15/h2-3,5,7-8,14H,4,6,9-11H2,1H3/b17-8-InChIKey
MLTIPHXHMBTTKL-IUXPMGMMSA-NSynonyms
1021109-62-5(7Z)3(11dioxidotetrahydrothiophen3yl)9methyl7(thiophen2ylmethylidene)34dihydro2Hfuro(32g)(13)benzoxazin6(7H)one
(7Z)3(11dioxothiolan3yl)9methyl7(thiophen2ylmethylidene)24dihydrofuro(32g)(13)benzoxazin6one
(Z)3(11dioxidotetrahydrothiophen3yl)9methyl7(thiophen2ylmethylene)34dihydro2Hbenzofuro(56e)(13)oxazin6(7H)one
1021109625
CC1=C2C(=CC3=C1OCN(C3)C4CCS(=O)(=O)C4)C(=O)C(=CC5=CC=CS5)O2
InChI=1SC20H19NO5S2c1121913(921(112519)144628(2324)1014)71618(22)17(2620(12)16)8153252715h2357814H46911H21H3b178
MFCD12201026
O=C1C(=Cc2cccs2)Oc2c1cc1CN(COc1c2C)C1CCS(=O)(=O)C1
ZINC000054333107
ZINC000054333108
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