Vitas-M small molecule compound
ethyl 2-{[(7-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)sulfonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK737170
SMILES CCOC(=O)c1c(sc2c1CCCC2)NS(=O)(=O)c1cc2NC(=O)COc2cc1C
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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 C20H22N2O6S2 MW 450.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O6S2/c1-3-27-20(24)18-12-6-4-5-7-15(12)29-19(18)22-30(25,26)16-9-13-14(8-11(16)2)28-10-17(23)21-13/h8-9,22H,3-7,10H2,1-2H3,(H,21,23)InChIKey
FRDLZBSOBASVHA-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)C3=CC4=C(C=C3C)OCC(=O)N4
ethyl2(((7methyl3oxo34dihydro2H14benzoxazin6yl)sulfonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((7methyl3oxo4H14benzoxazin6yl)sulfonylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC20H22N2O6S2c132720(24)1812645715(12)2919(18)2230(2526)1691314(811(16)2)281017(23)2113h8922H3710H212H3(H2123)
MFCD05860245
ZINC000012413897
ZINC12413897
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