Vitas-M small molecule compound
(2E)-4-{[3-(ethoxycarbonyl)-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl]amino}-4-oxobut-2-enoic acid
Catalog ID
STK722485
SMILES CCOC(=O)c1c(NC(=O)/C=C/C(=O)O)sc2c1CC(C)(C)OC2
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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 C16H19NO6S MW 353.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO6S/c1-4-22-15(21)13-9-7-16(2,3)23-8-10(9)24-14(13)17-11(18)5-6-12(19)20/h5-6H,4,7-8H2,1-3H3,(H,17,18)(H,19,20)/b6-5+InChIKey
HJPIFBMVVXTPBP-AATRIKPKSA-NSynonyms
372155-22-1(2E)4((3(ethoxycarbonyl)55dimethyl47dihydro5Hthieno(23c)pyran2yl)amino)4oxobut2enoicacid
(E)4((3(ethoxycarbonyl)55dimethyl57dihydro4Hthieno(23c)pyran2yl)amino)4oxobut2enoicacid
(E)4((3ETHOXYCARBONYL55DIMETHYL47DIHYDROTHIENO(23C)PYRAN2YL)AMINO)4OXOBUT2ENOICACID
372155221
CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=O)C=CC(=O)O
CCOC(=O)c1c(NC(=O)C=CC(=O)O)sc2c1CC(C)(C)OC2
InChI=1SC16H19NO6Sc142215(21)139716(23)23810(9)2414(13)1711(18)5612(19)20h56H478H213H3(H1718)(H1920)b65+
MFCD01878590
ZINC000002998670
ZINC2998670
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